6432805 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 33 8 8 8 7 6 6 6 6 6 6 1 1 1 1 1 1 1 1 3 -1 5 1 1 1 1 1 2 5 5 5 5 6 6 7 7 8 8 9 9 10 11 2 3 4 6 19 7 16 17 18 8 9 10 11 10 12 11 13 14 15 1 1 2 1 1 1 1 1 1 2 1 2 1 1 1 2 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 3 3 4 2 3 3 3 3.866 2.134 3.866 2.134 4.403 1.597 4.403 1.597 3 2.38 3.62 3.5369 1.655 2.655 1.655 1.655 -2.345 0.655 -1.345 0.155 0.155 -0.845 -0.845 0.465 0.465 -1.155 -1.155 -2.965 -2.345 -2.345 2.965 8 8 8 8 8 8 6 6 7 7 8 9 8 9 10 11 10 11 0 Compound Canonicalized 5 2021.05.07 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 168 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 3 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 2 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 1 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 00000371C0623000000000004000000000000000000000000000300000000000000000010000001C0110080000080881100030C080400000800024424000820000200200888C0000648808202280919180201060900008C8071000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 (4-azaniumylphenyl)-hydroxy-arsinate IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 (4-ammoniophenyl)-hydroxyarsinate IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 (4-azaniumylphenyl)-hydroxyarsinate IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 (4-azaniumylphenyl)-hydroxyarsinate IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 (4-azaniumylphenyl)-oxidanyl-arsinate IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 (4-ammoniophenyl)-hydroxy-arsinate InChI Standard 1 1.0.6 InChI iupac.org 2021.05.07 InChI=1S/C6H8AsNO3/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H,8H2,(H2,9,10,11) InChIKey Standard 1 1.0.6 InChI iupac.org 2021.05.07 XKNKHVGWJDPIRJ-UHFFFAOYSA-N Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 216.972013 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 C6H8AsNO3 Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 217.05 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.05.07 C1=CC(=CC=C1[NH3+])[As](=O)(O)[O-] SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.05.07 C1=CC(=CC=C1[NH3+])[As](=O)(O)[O-] Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 88 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 216.972013 11 0 0 0 0 0 0 0 1 -1