2-(3-methylphenoxy)-N-[3-(piperidin-1-ium-1-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-(3-methylphenoxy)-N-[3-(piperidin-1-ium-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-(3-methylphenoxy)-N-[3-(piperidin-1-ium-1-ylmethyl)phenyl]acetamide CAS Name: 2-(3-methylphenoxy)-N-[3-(1-piperidin-1-iumylmethyl)phenyl]acetamide IUPAC Name: 2-(3-methylphenoxy)-N-[3-(piperidin-1-ium-1-ylmethyl)phenyl]acetamide Traditional Name: 2-(3-methylphenoxy)-N-[3-(piperidin-1-ium-1-ylmethyl)phenyl]acetamide Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC2=CC=CC(=C2)C[NH+]3CCCCC3

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC2=CC=CC(=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C21H26N2O2/c1-17-7-5-10-20(13-17)25-16-21(24)22-19-9-6-8-18(14-19)15-23-11-3-2-4-12-23/h5-10,13-14H,2-4,11-12,15-16H2,1H3,(H,22,24)/p+1