3-(2-methylphenyl)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-propanamide

Systemtic Name: 3-(2-methylphenyl)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-propanamide Openeye Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-3-(o-tolyl)-N-phenethyl-propanamide CAS Name: 3-(2-methylphenyl)-N-[(1-methyl-4-piperidin-1-iumyl)methyl]-N-phenethylpropanamide IUPAC Name: 3-(2-methylphenyl)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethylpropanamide Traditional Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-3-(o-tolyl)-N-phenethyl-propionamide Formula: C25H35N2O+ MolecularWeight: 379.5582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCC(=O)N(CCC2=CC=CC=C2)CC3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=CC=C1CCC(=O)N(CCC2=CC=CC=C2)CC3CC[NH+](CC3)C

InChI

InChI=1S/C25H34N2O/c1-21-8-6-7-11-24(21)12-13-25(28)27(19-16-22-9-4-3-5-10-22)20-23-14-17-26(2)18-15-23/h3-11,23H,12-20H2,1-2H3/p+1