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

Systemtic Name: N-[[(3R)-1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-4-oxidanylidene-4-phenyl-butanamide Openeye Name: N-[[(3R)-1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-4-oxo-4-phenyl-butanamide CAS Name: N-[[(3R)-1-[2-(2-methoxyphenyl)ethyl]-3-piperidin-1-iumyl]methyl]-N-methyl-4-oxo-4-phenylbutanamide IUPAC Name: N-[[(3R)-1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-4-oxo-4-phenylbutanamide Traditional Name: 4-keto-N-[[(3R)-1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-4-phenyl-butyramide Formula: C26H35N2O3+ MolecularWeight: 423.5677

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCC[NH+](C1)CCC2=CC=CC=C2OC)C(=O)CCC(=O)C3=CC=CC=C3

Isomeric SMILES

CN(C[C@H]1CCC[NH+](C1)CCC2=CC=CC=C2OC)C(=O)CCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H34N2O3/c1-27(26(30)15-14-24(29)22-10-4-3-5-11-22)19-21-9-8-17-28(20-21)18-16-23-12-6-7-13-25(23)31-2/h3-7,10-13,21H,8-9,14-20H2,1-2H3/p+1/t21-/m1/s1