[[4-[(3-methylphenyl)carbonyldiazenyl]phenyl]amino] benzoate

Systemtic Name: [[4-[(3-methylphenyl)carbonyldiazenyl]phenyl]amino] benzoate Openeye Name: [4-(3-methylbenzoyl)azoanilino] benzoate CAS Name: benzoic acid [4-[(3-methylphenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(3-methylbenzoyl)diazenyl]anilino] benzoate Traditional Name: benzoic acid (4-m-toluoylazoanilino) ester Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N=NC2=CC=C(C=C2)NOC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N=NC2=CC=C(C=C2)NOC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H17N3O3/c1-15-6-5-9-17(14-15)20(25)23-22-18-10-12-19(13-11-18)24-27-21(26)16-7-3-2-4-8-16/h2-14,24H,1H3