2-methoxy-11-methyl-10-oxidanidyl-5-oxidanylidene-11H-pyrrolo[2,1-c][1,4]benzodiazepine-5,10-diium-7-one

Systemtic Name: 2-methoxy-11-methyl-10-oxidanidyl-5-oxidanylidene-11H-pyrrolo[2,1-c][1,4]benzodiazepine-5,10-diium-7-one Openeye Name: 2-methoxy-11-methyl-10-oxido-5-oxo-11H-pyrrolo[2,1-c][1,4]benzodiazepine-5,10-diium-7-one CAS Name: 2-methoxy-11-methyl-10-oxido-5-oxo-11H-pyrrolo[2,1-c][1,4]benzodiazepine-5,10-diium-7-one IUPAC Name: 2-methoxy-11-methyl-10-oxido-5-oxo-11H-pyrrolo[2,1-c][1,4]benzodiazepine-5,10-diium-7-one Traditional Name: 5-keto-2-methoxy-11-methyl-10-oxido-11H-pyrrolo[2,1-c][1,4]benzodiazepine-5,10-diium-7-one Formula: C14H13N2O4+ MolecularWeight: 273.26402

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C=CC(=C2)OC)[N+](=O)C=C3[N+]1(C=CC3=O)[O-]

Isomeric SMILES

CC1C2=C(C=CC(=C2)OC)[N+](=O)C=C3[N+]1(C=CC3=O)[O-]

InChI

InChI=1S/C14H13N2O4/c1-9-11-7-10(20-2)3-4-12(11)15(18)8-13-14(17)5-6-16(9,13)19/h3-9H,1-2H3/q+1