10-oxidanidyl-5-oxidanylidene-11-(phenylmethyl)-11H-pyrrolo[2,1-c][1,4]benzodiazepine-5,10-diium-7-one

Systemtic Name: 10-oxidanidyl-5-oxidanylidene-11-(phenylmethyl)-11H-pyrrolo[2,1-c][1,4]benzodiazepine-5,10-diium-7-one Openeye Name: 11-benzyl-10-oxido-5-oxo-11H-pyrrolo[2,1-c][1,4]benzodiazepine-5,10-diium-7-one CAS Name: 10-oxido-5-oxo-11-(phenylmethyl)-11H-pyrrolo[2,1-c][1,4]benzodiazepine-5,10-diium-7-one IUPAC Name: 11-benzyl-10-oxido-5-oxo-11H-pyrrolo[2,1-c][1,4]benzodiazepine-5,10-diium-7-one Traditional Name: 11-benzyl-5-keto-10-oxido-11H-pyrrolo[2,1-c][1,4]benzodiazepine-5,10-diium-7-one Formula: C19H15N2O3+ MolecularWeight: 319.334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C3=CC=CC=C3[N+](=O)C=C4[N+]2(C=CC4=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2C3=CC=CC=C3[N+](=O)C=C4[N+]2(C=CC4=O)[O-]

InChI

InChI=1S/C19H15N2O3/c22-19-10-11-21(24)17(12-14-6-2-1-3-7-14)15-8-4-5-9-16(15)20(23)13-18(19)21/h1-11,13,17H,12H2/q+1