[[4-[(2-oxidanyl-2,2-diphenyl-ethanoyl)diazenyl]phenyl]amino] 3-nitrobenzoate

Systemtic Name: [[4-[(2-oxidanyl-2,2-diphenyl-ethanoyl)diazenyl]phenyl]amino] 3-nitrobenzoate Openeye Name: [4-(2-hydroxy-2,2-diphenyl-acetyl)azoanilino] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-(2-hydroxy-1-oxo-2,2-diphenylethyl)azoanilino] ester IUPAC Name: [4-[(2-hydroxy-2,2-diphenylacetyl)diazenyl]anilino] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (4-benziloylazoanilino) ester Formula: C27H20N4O6 MolecularWeight: 496.4709

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)N=NC3=CC=C(C=C3)NOC(=O)C4=CC(=CC=C4)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)N=NC3=CC=C(C=C3)NOC(=O)C4=CC(=CC=C4)[N+](=O)[O-])O

InChI

InChI=1S/C27H20N4O6/c32-25(19-8-7-13-24(18-19)31(35)36)37-30-23-16-14-22(15-17-23)28-29-26(33)27(34,20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-18,30,34H