N-cyclohexyl-2-[2-[(phenylmethyl)amino]-3H-benzimidazol-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclohexyl-2-[2-[(phenylmethyl)amino]-3H-benzimidazol-1-ium-1-yl]ethanamide Openeye Name: 2-[2-(benzylamino)-3H-benzimidazol-1-ium-1-yl]-N-cyclohexyl-acetamide CAS Name: N-cyclohexyl-2-[2-[(phenylmethyl)amino]-3H-benzimidazol-1-ium-1-yl]acetamide IUPAC Name: 2-[2-(benzylamino)-3H-benzimidazol-1-ium-1-yl]-N-cyclohexylacetamide Traditional Name: 2-[2-(benzylamino)-3H-benzimidazol-1-ium-1-yl]-N-cyclohexyl-acetamide Formula: C22H27N4O+ MolecularWeight: 363.47598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C[N+]2=C(NC3=CC=CC=C32)NCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC(=O)C[N+]2=C(NC3=CC=CC=C32)NCC4=CC=CC=C4

InChI

InChI=1S/C22H26N4O/c27-21(24-18-11-5-2-6-12-18)16-26-20-14-8-7-13-19(20)25-22(26)23-15-17-9-3-1-4-10-17/h1,3-4,7-10,13-14,18H,2,5-6,11-12,15-16H2,(H2,23,24,25,27)/p+1