4,5-dimethoxy-2-[[N-(4-methylphenyl)sulfonyl-C-oxidanidyl-carbonimidoyl]amino]benzoate

Systemtic Name: 4,5-dimethoxy-2-[[N-(4-methylphenyl)sulfonyl-C-oxidanidyl-carbonimidoyl]amino]benzoate Openeye Name: 4,5-dimethoxy-2-[[C-oxido-N-(p-tolylsulfonyl)carbonimidoyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[[(4-methylphenyl)sulfonylimino-oxidomethyl]amino]benzoate IUPAC Name: 4,5-dimethoxy-2-[[N-(4-methylphenyl)sulfonyl-C-oxidocarbonimidoyl]amino]benzoate Traditional Name: 4,5-dimethoxy-2-[(C-oxido-N-tosyl-carbonimidoyl)amino]benzoate Formula: C17H16N2O7S-2 MolecularWeight: 392.38314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(NC2=CC(=C(C=C2C(=O)[O-])OC)OC)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=C(NC2=CC(=C(C=C2C(=O)[O-])OC)OC)[O-]

InChI

InChI=1S/C17H18N2O7S/c1-10-4-6-11(7-5-10)27(23,24)19-17(22)18-13-9-15(26-3)14(25-2)8-12(13)16(20)21/h4-9H,1-3H3,(H,20,21)(H2,18,19,22)/p-2