N-[2-[(4-cyanophenyl)methyl]-1-methyl-benzimidazol-5-yl]-1-methyl-2,3-dihydroindol-1-ium-1-carboxamide

Systemtic Name: N-[2-[(4-cyanophenyl)methyl]-1-methyl-benzimidazol-5-yl]-1-methyl-2,3-dihydroindol-1-ium-1-carboxamide Openeye Name: N-[2-[(4-cyanophenyl)methyl]-1-methyl-benzimidazol-5-yl]-1-methyl-indolin-1-ium-1-carboxamide CAS Name: N-[2-[(4-cyanophenyl)methyl]-1-methyl-5-benzimidazolyl]-1-methyl-2,3-dihydroindol-1-ium-1-carboxamide IUPAC Name: N-[2-[(4-cyanophenyl)methyl]-1-methylbenzimidazol-5-yl]-1-methyl-2,3-dihydroindol-1-ium-1-carboxamide Traditional Name: N-[2-(4-cyanobenzyl)-1-methyl-benzimidazol-5-yl]-1-methyl-indolin-1-ium-1-carboxamide Formula: C26H24N5O+ MolecularWeight: 422.50166

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)[N+]3(CCC4=CC=CC=C43)C)N=C1CC5=CC=C(C=C5)C#N

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)[N+]3(CCC4=CC=CC=C43)C)N=C1CC5=CC=C(C=C5)C#N

InChI

InChI=1S/C26H23N5O/c1-30-23-12-11-21(28-26(32)31(2)14-13-20-5-3-4-6-24(20)31)16-22(23)29-25(30)15-18-7-9-19(17-27)10-8-18/h3-12,16H,13-15H2,1-2H3/p+1