2-(4-nitrophenyl)-1-oxidanyl-4H-1,2,4-benzotriazin-3-one

Systemtic Name: 2-(4-nitrophenyl)-1-oxidanyl-4H-1,2,4-benzotriazin-3-one Openeye Name: 1-hydroxy-2-(4-nitrophenyl)-4H-1,2,4-benzotriazin-3-one CAS Name: 1-hydroxy-2-(4-nitrophenyl)-4H-1,2,4-benzotriazin-3-one IUPAC Name: 1-hydroxy-2-(4-nitrophenyl)-4H-1,2,4-benzotriazin-3-one Traditional Name: 1-hydroxy-2-(4-nitrophenyl)-4H-1,2,4-benzotriazin-3-one Formula: C13H10N4O4 MolecularWeight: 286.2429

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)N(N2O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)N(N2O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H10N4O4/c18-13-14-11-3-1-2-4-12(11)16(19)15(13)9-5-7-10(8-6-9)17(20)21/h1-8,19H,(H,14,18)