methyl 5-nitro-2-[(4-sulfamoylphenyl)methylamino]benzoate

Systemtic Name: methyl 5-nitro-2-[(4-sulfamoylphenyl)methylamino]benzoate Openeye Name: methyl 5-nitro-2-[(4-sulfamoylphenyl)methylamino]benzoate CAS Name: 5-nitro-2-[(4-sulfamoylphenyl)methylamino]benzoic acid methyl ester IUPAC Name: methyl 5-nitro-2-[(4-sulfamoylphenyl)methylamino]benzoate Traditional Name: 5-nitro-2-[(4-sulfamoylbenzyl)amino]benzoic acid methyl ester Formula: C15H15N3O6S MolecularWeight: 365.3611

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C15H15N3O6S/c1-24-15(19)13-8-11(18(20)21)4-7-14(13)17-9-10-2-5-12(6-3-10)25(16,22)23/h2-8,17H,9H2,1H3,(H2,16,22,23)