N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-propoxy-benzamide

Systemtic Name: N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-propoxy-benzamide Openeye Name: N-[(2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)ethyl]-3-propoxy-benzamide CAS Name: N-[(2R)-2-(4-methylphenyl)-2-(1-piperidin-1-iumyl)ethyl]-3-propoxybenzamide IUPAC Name: N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-ylethyl]-3-propoxybenzamide Traditional Name: N-[(2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)ethyl]-3-propoxy-benzamide Formula: C24H33N2O2+ MolecularWeight: 381.53102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NCC(C2=CC=C(C=C2)C)[NH+]3CCCCC3

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC[C@@H](C2=CC=C(C=C2)C)[NH+]3CCCCC3

InChI

InChI=1S/C24H32N2O2/c1-3-16-28-22-9-7-8-21(17-22)24(27)25-18-23(26-14-5-4-6-15-26)20-12-10-19(2)11-13-20/h7-13,17,23H,3-6,14-16,18H2,1-2H3,(H,25,27)/p+1/t23-/m0/s1