2-(1-methylpiperidin-1-ium-4-yl)ethyl 2,2-diphenylethanoate chloride

Systemtic Name: 2-(1-methylpiperidin-1-ium-4-yl)ethyl 2,2-diphenylethanoate chloride Openeye Name: 2-(1-methylpiperidin-1-ium-4-yl)ethyl 2,2-diphenylacetate chloride CAS Name: 2,2-diphenylacetic acid 2-(1-methyl-4-piperidin-1-iumyl)ethyl ester chloride IUPAC Name: 2-(1-methylpiperidin-1-ium-4-yl)ethyl 2,2-diphenylacetate chloride Traditional Name: 2,2-diphenylacetic acid 2-(1-methylpiperidin-1-ium-4-yl)ethyl ester chloride Formula: C22H28ClNO2 MolecularWeight: 373.91622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO2.ClH/c1-23-15-12-18(13-16-23)14-17-25-22(24)21(19-8-4-2-5-9-19)20-10-6-3-7-11-20;/h2-11,18,21H,12-17H2,1H3;1H