[[4-[(4-chlorophenyl)carbonyldiazenyl]phenyl]amino] 4-nitrobenzoate

Systemtic Name: [[4-[(4-chlorophenyl)carbonyldiazenyl]phenyl]amino] 4-nitrobenzoate Openeye Name: [4-(4-chlorobenzoyl)azoanilino] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-[(4-chlorophenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(4-chlorobenzoyl)diazenyl]anilino] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-(4-chlorobenzoyl)azoanilino] ester Formula: C20H13ClN4O5 MolecularWeight: 424.79402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H13ClN4O5/c21-15-5-1-13(2-6-15)19(26)23-22-16-7-9-17(10-8-16)24-30-20(27)14-3-11-18(12-4-14)25(28)29/h1-12,24H