(3R)-N-methyl-3-(2-methylphenyl)-N-(1-methylpiperidin-1-ium-4-yl)-3-phenyl-propanamide

Systemtic Name: (3R)-N-methyl-3-(2-methylphenyl)-N-(1-methylpiperidin-1-ium-4-yl)-3-phenyl-propanamide Openeye Name: (3R)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-3-(o-tolyl)-3-phenyl-propanamide CAS Name: (3R)-N-methyl-3-(2-methylphenyl)-N-(1-methyl-4-piperidin-1-iumyl)-3-phenylpropanamide IUPAC Name: (3R)-N-methyl-3-(2-methylphenyl)-N-(1-methylpiperidin-1-ium-4-yl)-3-phenylpropanamide Traditional Name: (3R)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-3-(o-tolyl)-3-phenyl-propionamide Formula: C23H31N2O+ MolecularWeight: 351.50504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CC(=O)N(C)C2CC[NH+](CC2)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1[C@H](CC(=O)N(C)C2CC[NH+](CC2)C)C3=CC=CC=C3

InChI

InChI=1S/C23H30N2O/c1-18-9-7-8-12-21(18)22(19-10-5-4-6-11-19)17-23(26)25(3)20-13-15-24(2)16-14-20/h4-12,20,22H,13-17H2,1-3H3/p+1/t22-/m1/s1