N-(2-methoxyethyl)-3-[1-[[3-(2-methylphenyl)phenyl]methyl]piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-(2-methoxyethyl)-3-[1-[[3-(2-methylphenyl)phenyl]methyl]piperidin-1-ium-4-yl]propanamide Openeye Name: N-(2-methoxyethyl)-3-[1-[[3-(o-tolyl)phenyl]methyl]piperidin-1-ium-4-yl]propanamide CAS Name: N-(2-methoxyethyl)-3-[1-[[3-(2-methylphenyl)phenyl]methyl]-4-piperidin-1-iumyl]propanamide IUPAC Name: N-(2-methoxyethyl)-3-[1-[[3-(2-methylphenyl)phenyl]methyl]piperidin-1-ium-4-yl]propanamide Traditional Name: N-(2-methoxyethyl)-3-[1-[3-(o-tolyl)benzyl]piperidin-1-ium-4-yl]propionamide Formula: C25H35N2O2+ MolecularWeight: 395.5576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(=CC=C2)C[NH+]3CCC(CC3)CCC(=O)NCCOC

Isomeric SMILES

CC1=CC=CC=C1C2=CC(=CC=C2)C[NH+]3CCC(CC3)CCC(=O)NCCOC

InChI

InChI=1S/C25H34N2O2/c1-20-6-3-4-9-24(20)23-8-5-7-22(18-23)19-27-15-12-21(13-16-27)10-11-25(28)26-14-17-29-2/h3-9,18,21H,10-17,19H2,1-2H3,(H,26,28)/p+1