5-oxidanidyl-11H-benzo[c][1,2]benzodiazepin-5-ium-3,8-diamine

Systemtic Name: 5-oxidanidyl-11H-benzo[c][1,2]benzodiazepin-5-ium-3,8-diamine Openeye Name: 5-oxido-11H-benzo[c][1,2]benzodiazepin-5-ium-3,8-diamine CAS Name: 5-oxido-11H-benzo[c][1,2]benzodiazepin-5-ium-3,8-diamine IUPAC Name: 5-oxido-11H-benzo[c][1,2]benzodiazepin-5-ium-3,8-diamine Traditional Name: (3-amino-5-oxido-11H-benzo[c][1,2]benzodiazepin-5-ium-8-yl)amine Formula: C13H12N4O MolecularWeight: 240.26058

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)N)N=[N+](C3=C1C=CC(=C3)N)[O-]

Isomeric SMILES

C1C2=C(C=C(C=C2)N)N=[N+](C3=C1C=CC(=C3)N)[O-]

InChI

InChI=1S/C13H12N4O/c14-10-3-1-8-5-9-2-4-11(15)7-13(9)17(18)16-12(8)6-10/h1-4,6-7H,5,14-15H2