[[4-[(4-nitrophenyl)carbonyldiazenyl]phenyl]amino] 3-nitrobenzoate

Systemtic Name: [[4-[(4-nitrophenyl)carbonyldiazenyl]phenyl]amino] 3-nitrobenzoate Openeye Name: [4-(4-nitrobenzoyl)azoanilino] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[(4-nitrophenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(4-nitrobenzoyl)diazenyl]anilino] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-(4-nitrobenzoyl)azoanilino] ester Formula: C20H13N5O7 MolecularWeight: 435.34652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H13N5O7/c26-19(13-4-10-17(11-5-13)24(28)29)22-21-15-6-8-16(9-7-15)23-32-20(27)14-2-1-3-18(12-14)25(30)31/h1-12,23H