2-(2,3-dimethylphenoxy)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide

Systemtic Name: 2-(2,3-dimethylphenoxy)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(2,3-dimethylphenoxy)acetamide CAS Name: 2-(2,3-dimethylphenoxy)-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(2,3-dimethylphenoxy)acetamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(2,3-dimethylphenoxy)acetamide Formula: C22H29N2O2+ MolecularWeight: 353.47786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCC(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)OCC(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H28N2O2/c1-17-7-6-10-21(18(17)2)26-16-22(25)23-20-11-13-24(14-12-20)15-19-8-4-3-5-9-19/h3-10,20H,11-16H2,1-2H3,(H,23,25)/p+1