2-(2,4-dimethylphenoxy)-N-(phenylmethyl)-N-pyridin-1-ium-2-yl-ethanamide

Systemtic Name: 2-(2,4-dimethylphenoxy)-N-(phenylmethyl)-N-pyridin-1-ium-2-yl-ethanamide Openeye Name: N-benzyl-2-(2,4-dimethylphenoxy)-N-pyridin-1-ium-2-yl-acetamide CAS Name: 2-(2,4-dimethylphenoxy)-N-(phenylmethyl)-N-(2-pyridin-1-iumyl)acetamide IUPAC Name: N-benzyl-2-(2,4-dimethylphenoxy)-N-pyridin-1-ium-2-ylacetamide Traditional Name: N-benzyl-2-(2,4-dimethylphenoxy)-N-pyridin-1-ium-2-yl-acetamide Formula: C22H23N2O2+ MolecularWeight: 347.43022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)N(CC2=CC=CC=C2)C3=CC=CC=[NH+]3)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)N(CC2=CC=CC=C2)C3=CC=CC=[NH+]3)C

InChI

InChI=1S/C22H22N2O2/c1-17-11-12-20(18(2)14-17)26-16-22(25)24(21-10-6-7-13-23-21)15-19-8-4-3-5-9-19/h3-14H,15-16H2,1-2H3/p+1