[[4-[(3-chlorophenyl)carbonyldiazenyl]phenyl]amino] 3-methylbenzoate

Systemtic Name: [[4-[(3-chlorophenyl)carbonyldiazenyl]phenyl]amino] 3-methylbenzoate Openeye Name: [4-(3-chlorobenzoyl)azoanilino] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [4-[(3-chlorophenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(3-chlorobenzoyl)diazenyl]anilino] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [4-(3-chlorobenzoyl)azoanilino] ester Formula: C21H16ClN3O3 MolecularWeight: 393.82304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H16ClN3O3/c1-14-4-2-6-16(12-14)21(27)28-25-19-10-8-18(9-11-19)23-24-20(26)15-5-3-7-17(22)13-15/h2-13,25H,1H3