3-methyl-1-oxidanylidene-5-[[(2S)-oxiran-2-yl]methyl]-5aH-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile

Systemtic Name: 3-methyl-1-oxidanylidene-5-[[(2S)-oxiran-2-yl]methyl]-5aH-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 3-methyl-5-[[(2S)-oxiran-2-yl]methyl]-1-oxo-5aH-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 3-methyl-5-[[(2S)-2-oxiranyl]methyl]-1-oxo-5aH-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 3-methyl-5-[[(2S)-oxiran-2-yl]methyl]-1-oxo-5aH-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 1-keto-3-methyl-5-[[(2S)-oxiran-2-yl]methyl]-5aH-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C16H14N3O2+ MolecularWeight: 280.30126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)[N+]2=C3C=CC=CC3N(C2=C1C#N)CC4CO4

Isomeric SMILES

CC1=CC(=O)[N+]2=C3C=CC=CC3N(C2=C1C#N)C[C@H]4CO4

InChI

InChI=1S/C16H14N3O2/c1-10-6-15(20)19-14-5-3-2-4-13(14)18(8-11-9-21-11)16(19)12(10)7-17/h2-6,11,13H,8-9H2,1H3/q+1/t11-,13?/m0/s1