(2S)-N-(2-methoxy-5-methyl-phenyl)-2-phenyl-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: (2S)-N-(2-methoxy-5-methyl-phenyl)-2-phenyl-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: (2S)-N-(2-methoxy-5-methyl-phenyl)-2-phenyl-2-piperidin-1-ium-1-yl-acetamide CAS Name: (2S)-N-(2-methoxy-5-methylphenyl)-2-phenyl-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: (2S)-N-(2-methoxy-5-methylphenyl)-2-phenyl-2-piperidin-1-ium-1-ylacetamide Traditional Name: (2S)-N-(2-methoxy-5-methyl-phenyl)-2-phenyl-2-piperidin-1-ium-1-yl-acetamide Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C2=CC=CC=C2)[NH+]3CCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@H](C2=CC=CC=C2)[NH+]3CCCCC3

InChI

InChI=1S/C21H26N2O2/c1-16-11-12-19(25-2)18(15-16)22-21(24)20(17-9-5-3-6-10-17)23-13-7-4-8-14-23/h3,5-6,9-12,15,20H,4,7-8,13-14H2,1-2H3,(H,22,24)/p+1/t20-/m0/s1