3-(benzotriazol-1-yl)-3-[(4-nitrophenyl)diazenyl]pentane-2,4-dione

Systemtic Name: 3-(benzotriazol-1-yl)-3-[(4-nitrophenyl)diazenyl]pentane-2,4-dione Openeye Name: 3-(benzotriazol-1-yl)-3-(4-nitrophenyl)azo-pentane-2,4-dione CAS Name: 3-(1-benzotriazolyl)-3-(4-nitrophenyl)azopentane-2,4-dione IUPAC Name: 3-(benzotriazol-1-yl)-3-[(4-nitrophenyl)diazenyl]pentane-2,4-dione Traditional Name: 3-(benzotriazol-1-yl)-3-(4-nitrophenyl)azo-pentane-2,4-dione Formula: C17H14N6O4 MolecularWeight: 366.33086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)C)(N=NC1=CC=C(C=C1)[N+](=O)[O-])N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC(=O)C(C(=O)C)(N=NC1=CC=C(C=C1)[N+](=O)[O-])N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H14N6O4/c1-11(24)17(12(2)25,22-16-6-4-3-5-15(16)19-21-22)20-18-13-7-9-14(10-8-13)23(26)27/h3-10H,1-2H3