N-[(1S,2S)-2-methylcyclohexyl]-2-[4-(4-methylphenyl)carbonylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(1S,2S)-2-methylcyclohexyl]-2-[4-(4-methylphenyl)carbonylpiperidin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(4-methylbenzoyl)piperidin-1-ium-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide CAS Name: N-[(1S,2S)-2-methylcyclohexyl]-2-[4-[(4-methylphenyl)-oxomethyl]-1-piperidin-1-iumyl]acetamide IUPAC Name: 2-[4-(4-methylbenzoyl)piperidin-1-ium-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide Traditional Name: N-[(1S,2S)-2-methylcyclohexyl]-2-(4-p-toluoylpiperidin-1-ium-1-yl)acetamide Formula: C22H33N2O2+ MolecularWeight: 357.50962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C[NH+]2CCC(CC2)C(=O)C3=CC=C(C=C3)C

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)C[NH+]2CCC(CC2)C(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H32N2O2/c1-16-7-9-18(10-8-16)22(26)19-11-13-24(14-12-19)15-21(25)23-20-6-4-3-5-17(20)2/h7-10,17,19-20H,3-6,11-15H2,1-2H3,(H,23,25)/p+1/t17-,20-/m0/s1