N-(3-nitrophenyl)-3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanamide

Systemtic Name: N-(3-nitrophenyl)-3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanamide Openeye Name: N-(3-nitrophenyl)-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide CAS Name: N-(3-nitrophenyl)-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide IUPAC Name: N-(3-nitrophenyl)-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide Traditional Name: 3-(4-keto-1,2,3-benzotriazin-3-yl)-N-(3-nitrophenyl)propionamide Formula: C16H13N5O4 MolecularWeight: 339.30552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N5O4/c22-15(17-11-4-3-5-12(10-11)21(24)25)8-9-20-16(23)13-6-1-2-7-14(13)18-19-20/h1-7,10H,8-9H2,(H,17,22)