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3-(2-methylpiperidin-1-ium-1-yl)propyl 4-prop-2-enoxybenzoate chloride

3-(2-methylpiperidin-1-ium-1-yl)propyl 4-prop-2-enoxybenzoate chloride

Systemtic Name:3-(2-methylpiperidin-1-ium-1-yl)propyl 4-prop-2-enoxybenzoate chloride
Openeye Name:3-(2-methylpiperidin-1-ium-1-yl)propyl 4-allyloxybenzoate chloride
CAS Name:4-prop-2-enoxybenzoic acid 3-(2-methyl-1-piperidin-1-iumyl)propyl ester chloride
IUPAC Name:3-(2-methylpiperidin-1-ium-1-yl)propyl 4-prop-2-enoxybenzoate chloride
Traditional Name:4-allyloxybenzoic acid 3-(2-methylpiperidin-1-ium-1-yl)propyl ester chloride
Formula: C19H28ClNO3
MolecularWeight: 353.88352
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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCOC(=O)C2=CC=C(C=C2)OCC=C.[Cl-]


Isomeric SMILES

CC1CCCC[NH+]1CCCOC(=O)C2=CC=C(C=C2)OCC=C.[Cl-]


InChI

InChI=1S/C19H27NO3.ClH/c1-3-14-22-18-10-8-17(9-11-18)19(21)23-15-6-13-20-12-5-4-7-16(20)2;/h3,8-11,16H,1,4-7,12-15H2,2H3;1H


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