[[4-[(4-nitrophenyl)carbonyldiazenyl]phenyl]amino] 3,5-dinitrobenzoate

Systemtic Name: [[4-[(4-nitrophenyl)carbonyldiazenyl]phenyl]amino] 3,5-dinitrobenzoate Openeye Name: [4-(4-nitrobenzoyl)azoanilino] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [4-[(4-nitrophenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(4-nitrobenzoyl)diazenyl]anilino] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [4-(4-nitrobenzoyl)azoanilino] ester Formula: C20H12N6O9 MolecularWeight: 480.34408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N=NC2=CC=C(C=C2)NOC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)N=NC2=CC=C(C=C2)NOC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H12N6O9/c27-19(12-1-7-16(8-2-12)24(29)30)22-21-14-3-5-15(6-4-14)23-35-20(28)13-9-17(25(31)32)11-18(10-13)26(33)34/h1-11,23H