(2S)-N-(3-methoxyphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-phenyl-ethanamide

Systemtic Name: (2S)-N-(3-methoxyphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-phenyl-ethanamide Openeye Name: (2S)-N-(3-methoxyphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-phenyl-acetamide CAS Name: (2S)-N-(3-methoxyphenyl)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]-2-phenylacetamide IUPAC Name: (2S)-N-(3-methoxyphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-phenylacetamide Traditional Name: (2S)-N-(3-methoxyphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-phenyl-acetamide Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(C2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

C[C@H]1CCC[NH+](C1)[C@@H](C2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H26N2O2/c1-16-8-7-13-23(15-16)20(17-9-4-3-5-10-17)21(24)22-18-11-6-12-19(14-18)25-2/h3-6,9-12,14,16,20H,7-8,13,15H2,1-2H3,(H,22,24)/p+1/t16-,20-/m0/s1