8751 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 16 11 8 8 8 7 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 2 1 3 -1 1 1 1 1 6 6 7 7 7 8 8 8 9 9 9 10 10 10 11 11 11 12 12 3 4 5 6 7 24 8 9 13 10 14 15 11 16 17 12 18 19 12 20 21 22 23 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 3.732 4.5981 4.5981 3.232 4.232 2.866 2.866 2 3.732 2 3.732 2.866 3.403 1.788 1.3894 4.3426 3.9441 1.3894 1.788 3.9441 4.3426 2.4675 3.2646 2.3291 1 2.5 1.5 1.866 0.134 0.5 -0.5 -1 -1 -2 -2 -2.5 -0.19 -0.4174 -1.1077 -1.1077 -0.4174 -1.8923 -2.5826 -2.5826 -1.8923 -2.975 -2.975 0.81 0 Compound Canonicalized 5 2007.06.29 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 187 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 1 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 1 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371C0623020400000000000000000000000000000000000300000000000000000000000001C00104000000828C100040000004000000000000000300000000000000000800000000000020080000000000010000000011000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 sodium;N-cyclohexylsulfamate IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 sodium;N-cyclohexylsulfamate IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 sodium;<I>N</I>-cyclohexylsulfamate IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 sodium;N-cyclohexylsulfamate IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 sodium;N-cyclohexylsulfamate IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 sodium;N-cyclohexylsulfamate InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/C6H13NO3S.Na/c8-11(9,10)7-6-4-2-1-3-5-6;/h6-7H,1-5H2,(H,8,9,10);/q;+1/p-1 InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 UDIPTWFVPPPURJ-UHFFFAOYSA-M Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 201.04355870 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 C6H12NNaO3S Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 201.22 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 C1CCC(CC1)NS(=O)(=O)[O-].[Na+] SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 C1CCC(CC1)NS(=O)(=O)[O-].[Na+] Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 77.6 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 201.04355870 12 0 0 0 0 0 0 0 2 -1