5-methyl-9-nitro-11-oxidanylidene-10aH-benzimidazolo[1,2-b]isoquinolin-5-ium-6-carbonitrile

Systemtic Name: 5-methyl-9-nitro-11-oxidanylidene-10aH-benzimidazolo[1,2-b]isoquinolin-5-ium-6-carbonitrile Openeye Name: 5-methyl-9-nitro-11-oxo-10aH-benzimidazolo[1,2-b]isoquinolin-5-ium-6-carbonitrile CAS Name: 5-methyl-9-nitro-11-oxo-10aH-benzimidazolo[1,2-b]isoquinolin-5-ium-6-carbonitrile IUPAC Name: 5-methyl-9-nitro-11-oxo-10aH-benzimidazolo[1,2-b]isoquinolin-5-ium-6-carbonitrile Traditional Name: 11-keto-5-methyl-9-nitro-10aH-benzimidazol[1,2-b]isoquinolin-5-ium-6-carbonitrile Formula: C17H11N4O3+ MolecularWeight: 319.29424

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C(=C3C=CC(=CC3C(=O)N2C4=CC=CC=C41)[N+](=O)[O-])C#N

Isomeric SMILES

C[N+]1=C2C(=C3C=CC(=CC3C(=O)N2C4=CC=CC=C41)[N+](=O)[O-])C#N

InChI

InChI=1S/C17H11N4O3/c1-19-14-4-2-3-5-15(14)20-16(19)13(9-18)11-7-6-10(21(23)24)8-12(11)17(20)22/h2-8,12H,1H3/q+1