312154 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 15 8 8 8 7 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 4 5 5 6 6 7 7 8 8 8 9 9 10 10 11 12 12 13 13 14 16 16 17 17 18 18 18 19 19 20 2 3 5 6 7 15 9 21 15 22 11 12 10 11 16 13 18 14 17 23 14 24 15 25 26 19 27 20 28 29 30 31 20 32 33 1 2 1 1 1 2 1 1 1 1 2 1 1 1 2 2 1 1 2 1 2 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 3 5 6 3 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 4.5 5.366 4.5 5 3.5 5 6.232 7.9641 3 7.9641 7.0981 6.232 3.5 7.0981 4.5 8.858 8.858 2 9.7641 9.7641 3.19 5.62 7.0981 5.6951 3.19 7.0981 8.8509 8.8509 2 1.38 2 10.2998 10.2998 -0.799 -1.299 -1.799 1.799 -0.799 0.067 -0.799 -0.799 0.067 0.201 -1.299 0.201 0.933 0.701 0.933 -1.3337 0.7356 0.067 -0.8199 0.2218 -1.336 0.067 -1.919 0.511 1.47 1.321 -1.9537 1.3556 0.687 0.067 -0.553 -1.1319 0.5338 3 8 8 8 8 8 8 8 8 8 8 8 1 7 7 8 8 8 10 10 12 16 17 19 2 11 12 10 11 16 14 17 14 19 20 20 0 Compound Canonicalized 5 2019.01.04 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 477 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 4 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 2 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 2 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371C0733002000000000000000000000000000000000000306080000000000000C15000001E00108020000C0C8198003206C04001108842255250808200002022000888000608C808262280111280300024D01108894780C0B00EA0000100001000004000020000200000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 6-methyl-2-(2-naphthyloxy)-2-oxo-1,3-dihydro-1,3,2lambda5-diazaphosphinin-4-one IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 6-methyl-2-(2-naphthalenyloxy)-2-oxo-1,3-dihydro-1,3,2lambda5-diazaphosphorin-4-one IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 6-methyl-2-naphthalen-2-yloxy-2-oxo-1,3-dihydro-1,3,2&lambda;<SUP>5</SUP>-diazaphosphinin-4-one IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 6-methyl-2-naphthalen-2-yloxy-2-oxo-1,3-dihydro-1,3,2lambda5-diazaphosphinin-4-one IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 6-methyl-2-naphthalen-2-yloxy-2-oxidanylidene-1,3-dihydro-1,3,2lambda5-diazaphosphinin-4-one IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 2-keto-6-methyl-2-(2-naphthoxy)-1,3-dihydro-1,3,2lambda5-diazaphosphorin-4-one InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/C14H13N2O3P/c1-10-8-14(17)16-20(18,15-10)19-13-7-6-11-4-2-3-5-12(11)9-13/h2-9H,1H3,(H2,15,16,17,18) InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 PKSVLKGIROYRDK-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2019.06.18 2.6 Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 288.06637928 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 C14H13N2O3P Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 288.24 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 CC1=CC(=O)NP(=O)(N1)OC2=CC3=CC=CC=C3C=C2 SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 CC1=CC(=O)NP(=O)(N1)OC2=CC3=CC=CC=C3C=C2 Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 67.4 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 288.06637928 20 1 0 1 0 0 0 0 1 -1