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

Systemtic Name: [2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 4-(aminocarbonylamino)benzoate Openeye Name: [2-(4-chloro-3-nitro-anilino)-2-oxo-1-phenyl-ethyl] 4-ureidobenzoate CAS Name: 4-(carbamoylamino)benzoic acid [2-(4-chloro-3-nitroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(4-chloro-3-nitroanilino)-2-oxo-1-phenylethyl] 4-(carbamoylamino)benzoate Traditional Name: 4-ureidobenzoic acid [2-(4-chloro-3-nitro-anilino)-2-keto-1-phenyl-ethyl] ester Formula: C22H17ClN4O6 MolecularWeight: 468.84658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)NC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)NC(=O)N

InChI

InChI=1S/C22H17ClN4O6/c23-17-11-10-16(12-18(17)27(31)32)25-20(28)19(13-4-2-1-3-5-13)33-21(29)14-6-8-15(9-7-14)26-22(24)30/h1-12,19H,(H,25,28)(H3,24,26,30)