N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-2-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)ethanamide

Systemtic Name: N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-2-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)ethanamide Openeye Name: N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-2-(3-methyl-2-oxo-benzimidazol-1-yl)acetamide CAS Name: N-[(2R)-2-(4-methoxyphenyl)-2-(1-piperidin-1-iumyl)ethyl]-2-(3-methyl-2-oxo-1-benzimidazolyl)acetamide IUPAC Name: N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-ylethyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide Traditional Name: 2-(2-keto-3-methyl-benzimidazol-1-yl)-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]acetamide Formula: C24H31N4O3+ MolecularWeight: 423.52794

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CC(=O)NCC(C3=CC=C(C=C3)OC)[NH+]4CCCCC4

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CC(=O)NC[C@@H](C3=CC=C(C=C3)OC)[NH+]4CCCCC4

InChI

InChI=1S/C24H30N4O3/c1-26-20-8-4-5-9-21(20)28(24(26)30)17-23(29)25-16-22(27-14-6-3-7-15-27)18-10-12-19(31-2)13-11-18/h4-5,8-13,22H,3,6-7,14-17H2,1-2H3,(H,25,29)/p+1/t22-/m0/s1