[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-[(3-nitrophenyl)carbonylamino]benzoate

Systemtic Name: [2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-[(3-nitrophenyl)carbonylamino]benzoate Openeye Name: [2-(3-chloro-4-methyl-anilino)-2-oxo-ethyl] 3-[(3-nitrobenzoyl)amino]benzoate CAS Name: 3-[[(3-nitrophenyl)-oxomethyl]amino]benzoic acid [2-(3-chloro-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-4-methylanilino)-2-oxoethyl] 3-[(3-nitrobenzoyl)amino]benzoate Traditional Name: 3-[(3-nitrobenzoyl)amino]benzoic acid [2-(3-chloro-4-methyl-anilino)-2-keto-ethyl] ester Formula: C23H18ClN3O6 MolecularWeight: 467.85852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H18ClN3O6/c1-14-8-9-18(12-20(14)24)25-21(28)13-33-23(30)16-5-2-6-17(10-16)26-22(29)15-4-3-7-19(11-15)27(31)32/h2-12H,13H2,1H3,(H,25,28)(H,26,29)