methyl 3-[[4-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]phenyl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[4-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]phenyl]carbonylamino]benzoate Openeye Name: methyl 3-[[4-[(4-chloro-3-nitro-phenyl)sulfonylamino]benzoyl]amino]benzoate CAS Name: 3-[[[4-[(4-chloro-3-nitrophenyl)sulfonylamino]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-[(4-chloro-3-nitrophenyl)sulfonylamino]benzoyl]amino]benzoate Traditional Name: 3-[[4-[(4-chloro-3-nitro-phenyl)sulfonylamino]benzoyl]amino]benzoic acid methyl ester Formula: C21H16ClN3O7S MolecularWeight: 489.88564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H16ClN3O7S/c1-32-21(27)14-3-2-4-16(11-14)23-20(26)13-5-7-15(8-6-13)24-33(30,31)17-9-10-18(22)19(12-17)25(28)29/h2-12,24H,1H3,(H,23,26)