N-(4-acetamidophenyl)-3-(4-cyano-3-methyl-1-oxidanylidene-5,5a-dihydropyrido[1,2-a]benzimidazol-10-ium-2-yl)propanamide

Systemtic Name: N-(4-acetamidophenyl)-3-(4-cyano-3-methyl-1-oxidanylidene-5,5a-dihydropyrido[1,2-a]benzimidazol-10-ium-2-yl)propanamide Openeye Name: N-(4-acetamidophenyl)-3-(4-cyano-3-methyl-1-oxo-5,5a-dihydropyrido[1,2-a]benzimidazol-10-ium-2-yl)propanamide CAS Name: N-(4-acetamidophenyl)-3-(4-cyano-3-methyl-1-oxo-5,5a-dihydropyrido[1,2-a]benzimidazol-10-ium-2-yl)propanamide IUPAC Name: N-(4-acetamidophenyl)-3-(4-cyano-3-methyl-1-oxo-5,5a-dihydropyrido[1,2-a]benzimidazol-10-ium-2-yl)propanamide Traditional Name: N-(4-acetamidophenyl)-3-(4-cyano-1-keto-3-methyl-5,5a-dihydropyrido[1,2-a]benzimidazol-10-ium-2-yl)propionamide Formula: C24H22N5O3+ MolecularWeight: 428.46318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)[N+]2=C3C=CC=CC3NC2=C1C#N)CCC(=O)NC4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=C(C(=O)[N+]2=C3C=CC=CC3NC2=C1C#N)CCC(=O)NC4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C24H21N5O3/c1-14-18(11-12-22(31)27-17-9-7-16(8-10-17)26-15(2)30)24(32)29-21-6-4-3-5-20(21)28-23(29)19(14)13-25/h3-10,20H,11-12H2,1-2H3,(H2-,26,27,28,30,31,32)/p+1