[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 3-(aminocarbonylamino)benzoate

Systemtic Name: [2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 3-(aminocarbonylamino)benzoate Openeye Name: [2-(4-methyl-2-nitro-anilino)-2-oxo-1-phenyl-ethyl] 3-ureidobenzoate CAS Name: 3-(carbamoylamino)benzoic acid [2-(4-methyl-2-nitroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(4-methyl-2-nitroanilino)-2-oxo-1-phenylethyl] 3-(carbamoylamino)benzoate Traditional Name: 3-ureidobenzoic acid [2-keto-2-(4-methyl-2-nitro-anilino)-1-phenyl-ethyl] ester Formula: C23H20N4O6 MolecularWeight: 448.4281

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N4O6/c1-14-10-11-18(19(12-14)27(31)32)26-21(28)20(15-6-3-2-4-7-15)33-22(29)16-8-5-9-17(13-16)25-23(24)30/h2-13,20H,1H3,(H,26,28)(H3,24,25,30)