[[4-[(3,4-dimethoxyphenyl)carbonyldiazenyl]phenyl]amino] 4-nitrobenzoate

Systemtic Name: [[4-[(3,4-dimethoxyphenyl)carbonyldiazenyl]phenyl]amino] 4-nitrobenzoate Openeye Name: [4-(3,4-dimethoxybenzoyl)azoanilino] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-[(3,4-dimethoxyphenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(3,4-dimethoxybenzoyl)diazenyl]anilino] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (4-veratroylazoanilino) ester Formula: C22H18N4O7 MolecularWeight: 450.40092

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N=NC2=CC=C(C=C2)NOC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N=NC2=CC=C(C=C2)NOC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H18N4O7/c1-31-19-12-5-15(13-20(19)32-2)21(27)24-23-16-6-8-17(9-7-16)25-33-22(28)14-3-10-18(11-4-14)26(29)30/h3-13,25H,1-2H3