(1-methylpiperidin-1-ium-4-yl) 2,2-diphenyl-2-propoxy-ethanoate chloride

Systemtic Name: (1-methylpiperidin-1-ium-4-yl) 2,2-diphenyl-2-propoxy-ethanoate chloride Openeye Name: (1-methylpiperidin-1-ium-4-yl) 2,2-diphenyl-2-propoxy-acetate chloride CAS Name: 2,2-diphenyl-2-propoxyacetic acid (1-methyl-4-piperidin-1-iumyl) ester chloride IUPAC Name: (1-methylpiperidin-1-ium-4-yl) 2,2-diphenyl-2-propoxyacetate chloride Traditional Name: 2,2-diphenyl-2-propoxy-acetic acid (1-methylpiperidin-1-ium-4-yl) ester chloride Formula: C23H30ClNO3 MolecularWeight: 403.9422

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OC3CC[NH+](CC3)C.[Cl-]

Isomeric SMILES

CCCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OC3CC[NH+](CC3)C.[Cl-]

InChI

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