(1-ethylpiperidin-1-ium-4-yl)methyl 2-methoxy-2,2-diphenyl-ethanoate chloride

Systemtic Name: (1-ethylpiperidin-1-ium-4-yl)methyl 2-methoxy-2,2-diphenyl-ethanoate chloride Openeye Name: (1-ethylpiperidin-1-ium-4-yl)methyl 2-methoxy-2,2-diphenyl-acetate chloride CAS Name: 2-methoxy-2,2-diphenylacetic acid (1-ethyl-4-piperidin-1-iumyl)methyl ester chloride IUPAC Name: (1-ethylpiperidin-1-ium-4-yl)methyl 2-methoxy-2,2-diphenylacetate chloride Traditional Name: 2-methoxy-2,2-diphenyl-acetic acid (1-ethylpiperidin-1-ium-4-yl)methyl ester chloride Formula: C23H30ClNO3 MolecularWeight: 403.9422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29NO3.ClH/c1-3-24-16-14-19(15-17-24)18-27-22(25)23(26-2,20-10-6-4-7-11-20)21-12-8-5-9-13-21;/h4-13,19H,3,14-18H2,1-2H3;1H