1-[(4-methylphenyl)methyl]-N-[(1R)-1-phenylethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-methylphenyl)methyl]-N-[(1R)-1-phenylethyl]piperidin-1-ium-4-carboxamide Openeye Name: N-[(1R)-1-phenylethyl]-1-(p-tolylmethyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-methylphenyl)methyl]-N-[(1R)-1-phenylethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-methylphenyl)methyl]-N-[(1R)-1-phenylethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-methylbenzyl)-N-[(1R)-1-phenylethyl]piperidin-1-ium-4-carboxamide Formula: C22H29N2O+ MolecularWeight: 337.47846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)N[C@H](C)C3=CC=CC=C3

InChI

InChI=1S/C22H28N2O/c1-17-8-10-19(11-9-17)16-24-14-12-21(13-15-24)22(25)23-18(2)20-6-4-3-5-7-20/h3-11,18,21H,12-16H2,1-2H3,(H,23,25)/p+1/t18-/m1/s1