3-[(3R)-1-(1H-benzimidazol-2-ylmethyl)piperidin-1-ium-3-yl]-N-(4-methoxy-2-methyl-phenyl)propanamide

Systemtic Name: 3-[(3R)-1-(1H-benzimidazol-2-ylmethyl)piperidin-1-ium-3-yl]-N-(4-methoxy-2-methyl-phenyl)propanamide Openeye Name: 3-[(3R)-1-(1H-benzimidazol-2-ylmethyl)piperidin-1-ium-3-yl]-N-(4-methoxy-2-methyl-phenyl)propanamide CAS Name: 3-[(3R)-1-(1H-benzimidazol-2-ylmethyl)-3-piperidin-1-iumyl]-N-(4-methoxy-2-methylphenyl)propanamide IUPAC Name: 3-[(3R)-1-(1H-benzimidazol-2-ylmethyl)piperidin-1-ium-3-yl]-N-(4-methoxy-2-methylphenyl)propanamide Traditional Name: 3-[(3R)-1-(1H-benzimidazol-2-ylmethyl)piperidin-1-ium-3-yl]-N-(4-methoxy-2-methyl-phenyl)propionamide Formula: C24H31N4O2+ MolecularWeight: 407.52854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)NC(=O)CCC2CCC[NH+](C2)CC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C=CC(=C1)OC)NC(=O)CC[C@H]2CCC[NH+](C2)CC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C24H30N4O2/c1-17-14-19(30-2)10-11-20(17)27-24(29)12-9-18-6-5-13-28(15-18)16-23-25-21-7-3-4-8-22(21)26-23/h3-4,7-8,10-11,14,18H,5-6,9,12-13,15-16H2,1-2H3,(H,25,26)(H,27,29)/p+1/t18-/m1/s1