[[4-[(2-methylphenyl)carbonyldiazenyl]phenyl]amino] 3-chloranylbenzoate

Systemtic Name: [[4-[(2-methylphenyl)carbonyldiazenyl]phenyl]amino] 3-chloranylbenzoate Openeye Name: [4-(2-methylbenzoyl)azoanilino] 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid [4-[(2-methylphenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(2-methylbenzoyl)diazenyl]anilino] 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid (4-o-toluoylazoanilino) ester Formula: C21H16ClN3O3 MolecularWeight: 393.82304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N=NC2=CC=C(C=C2)NOC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)N=NC2=CC=C(C=C2)NOC(=O)C3=CC(=CC=C3)Cl

InChI

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