[4-[(4-chlorophenyl)carbamoyl]phenyl] 4-methyl-3-nitro-benzoate

Systemtic Name: [4-[(4-chlorophenyl)carbamoyl]phenyl] 4-methyl-3-nitro-benzoate Openeye Name: [4-[(4-chlorophenyl)carbamoyl]phenyl] 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid [4-[(4-chloroanilino)-oxomethyl]phenyl] ester IUPAC Name: [4-[(4-chlorophenyl)carbamoyl]phenyl] 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid [4-[(4-chlorophenyl)carbamoyl]phenyl] ester Formula: C21H15ClN2O5 MolecularWeight: 410.8072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H15ClN2O5/c1-13-2-3-15(12-19(13)24(27)28)21(26)29-18-10-4-14(5-11-18)20(25)23-17-8-6-16(22)7-9-17/h2-12H,1H3,(H,23,25)