2-(benzimidazol-1-yl)-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]ethanamide

Systemtic Name: 2-(benzimidazol-1-yl)-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]ethanamide Openeye Name: 2-(benzimidazol-1-yl)-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]acetamide CAS Name: 2-(1-benzimidazolyl)-N-[(3S)-1-[(3-methoxyphenyl)methyl]-3-piperidin-1-iumyl]acetamide IUPAC Name: 2-(benzimidazol-1-yl)-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]acetamide Traditional Name: 2-(benzimidazol-1-yl)-N-[(3S)-1-m-anisylpiperidin-1-ium-3-yl]acetamide Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+]2CCCC(C2)NC(=O)CN3C=NC4=CC=CC=C43

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+]2CCC[C@@H](C2)NC(=O)CN3C=NC4=CC=CC=C43

InChI

InChI=1S/C22H26N4O2/c1-28-19-8-4-6-17(12-19)13-25-11-5-7-18(14-25)24-22(27)15-26-16-23-20-9-2-3-10-21(20)26/h2-4,6,8-10,12,16,18H,5,7,11,13-15H2,1H3,(H,24,27)/p+1/t18-/m0/s1