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(1-methylpiperidin-1-ium-3-yl) 2-butoxy-2,2-diphenyl-ethanoate chloride

(1-methylpiperidin-1-ium-3-yl) 2-butoxy-2,2-diphenyl-ethanoate chloride

Systemtic Name:(1-methylpiperidin-1-ium-3-yl) 2-butoxy-2,2-diphenyl-ethanoate chloride
Openeye Name:(1-methylpiperidin-1-ium-3-yl) 2-butoxy-2,2-diphenyl-acetate chloride
CAS Name:2-butoxy-2,2-diphenylacetic acid (1-methyl-3-piperidin-1-iumyl) ester chloride
IUPAC Name:(1-methylpiperidin-1-ium-3-yl) 2-butoxy-2,2-diphenylacetate chloride
Traditional Name:2-butoxy-2,2-diphenyl-acetic acid (1-methylpiperidin-1-ium-3-yl) ester chloride
Formula: C24H32ClNO3
MolecularWeight: 417.96878
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OC3CCC[NH+](C3)C.[Cl-]


Isomeric SMILES

CCCCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OC3CCC[NH+](C3)C.[Cl-]


InChI

InChI=1S/C24H31NO3.ClH/c1-3-4-18-27-24(20-12-7-5-8-13-20,21-14-9-6-10-15-21)23(26)28-22-16-11-17-25(2)19-22;/h5-10,12-15,22H,3-4,11,16-19H2,1-2H3;1H


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