1-pyridin-1-ium-2-ylpropan-2-yl 2,2-diphenylethanoate chloride

Systemtic Name: 1-pyridin-1-ium-2-ylpropan-2-yl 2,2-diphenylethanoate chloride Openeye Name: (1-methyl-2-pyridin-1-ium-2-yl-ethyl) 2,2-diphenylacetate chloride CAS Name: 2,2-diphenylacetic acid 1-(2-pyridin-1-iumyl)propan-2-yl ester chloride IUPAC Name: 1-pyridin-1-ium-2-ylpropan-2-yl 2,2-diphenylacetate chloride Traditional Name: 2,2-diphenylacetic acid (1-methyl-2-pyridin-1-ium-2-yl-ethyl) ester chloride Formula: C22H22ClNO2 MolecularWeight: 367.86858

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=[NH+]1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CC(CC1=CC=CC=[NH+]1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C22H21NO2.ClH/c1-17(16-20-14-8-9-15-23-20)25-22(24)21(18-10-4-2-5-11-18)19-12-6-3-7-13-19;/h2-15,17,21H,16H2,1H3;1H