(2R)-N-(2,6-dimethylphenyl)-2-[4-(4-methylphenyl)carbonylpiperidin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(2,6-dimethylphenyl)-2-[4-(4-methylphenyl)carbonylpiperidin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-(2,6-dimethylphenyl)-2-[4-(4-methylbenzoyl)piperidin-1-ium-1-yl]propanamide CAS Name: (2R)-N-(2,6-dimethylphenyl)-2-[4-[(4-methylphenyl)-oxomethyl]-1-piperidin-1-iumyl]propanamide IUPAC Name: (2R)-N-(2,6-dimethylphenyl)-2-[4-(4-methylbenzoyl)piperidin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-(2,6-dimethylphenyl)-2-(4-p-toluoylpiperidin-1-ium-1-yl)propionamide Formula: C24H31N2O2+ MolecularWeight: 379.51514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2CC[NH+](CC2)C(C)C(=O)NC3=C(C=CC=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2CC[NH+](CC2)[C@H](C)C(=O)NC3=C(C=CC=C3C)C

InChI

InChI=1S/C24H30N2O2/c1-16-8-10-20(11-9-16)23(27)21-12-14-26(15-13-21)19(4)24(28)25-22-17(2)6-5-7-18(22)3/h5-11,19,21H,12-15H2,1-4H3,(H,25,28)/p+1/t19-/m1/s1