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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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