4-[[4-methyl-3-[(3-nitrophenyl)sulfamoyl]phenyl]carbonylamino]benzoate

Systemtic Name: 4-[[4-methyl-3-[(3-nitrophenyl)sulfamoyl]phenyl]carbonylamino]benzoate Openeye Name: 4-[[4-methyl-3-[(3-nitrophenyl)sulfamoyl]benzoyl]amino]benzoate CAS Name: 4-[[[4-methyl-3-[(3-nitrophenyl)sulfamoyl]phenyl]-oxomethyl]amino]benzoate IUPAC Name: 4-[[4-methyl-3-[(3-nitrophenyl)sulfamoyl]benzoyl]amino]benzoate Traditional Name: 4-[[4-methyl-3-[(3-nitrophenyl)sulfamoyl]benzoyl]amino]benzoate Formula: C21H16N3O7S- MolecularWeight: 454.43264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)[O-])S(=O)(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)[O-])S(=O)(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O7S/c1-13-5-6-15(20(25)22-16-9-7-14(8-10-16)21(26)27)11-19(13)32(30,31)23-17-3-2-4-18(12-17)24(28)29/h2-12,23H,1H3,(H,22,25)(H,26,27)/p-1