1-methyl-5-oxidanidyl-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium-8-carbonitrile

Systemtic Name: 1-methyl-5-oxidanidyl-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium-8-carbonitrile Openeye Name: 1-methyl-5-oxido-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium-8-carbonitrile CAS Name: 1-methyl-5-oxido-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium-8-carbonitrile IUPAC Name: 1-methyl-5-oxido-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium-8-carbonitrile Traditional Name: 1-methyl-5-oxido-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium-8-carbonitrile Formula: C19H14N4O MolecularWeight: 314.34066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2N1C3=C(C=C(C=C3)C#N)C(=[N+](C2)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=CN=C2N1C3=C(C=C(C=C3)C#N)C(=[N+](C2)[O-])C4=CC=CC=C4

InChI

InChI=1S/C19H14N4O/c1-13-11-21-18-12-22(24)19(15-5-3-2-4-6-15)16-9-14(10-20)7-8-17(16)23(13)18/h2-9,11H,12H2,1H3