(1-methylpiperidin-1-ium-1-yl)methyl 1-thiophen-3-ylcyclopentane-1-carboxylate hydrochloride

Systemtic Name: (1-methylpiperidin-1-ium-1-yl)methyl 1-thiophen-3-ylcyclopentane-1-carboxylate hydrochloride Openeye Name: (1-methylpiperidin-1-ium-1-yl)methyl 1-(3-thienyl)cyclopentanecarboxylate hydrochloride CAS Name: 1-(3-thiophenyl)-1-cyclopentanecarboxylic acid (1-methyl-1-piperidin-1-iumyl)methyl ester hydrochloride IUPAC Name: (1-methylpiperidin-1-ium-1-yl)methyl 1-thiophen-3-ylcyclopentane-1-carboxylate hydrochloride Traditional Name: 1-(3-thienyl)cyclopentanecarboxylic acid (1-methylpiperidin-1-ium-1-yl)methyl ester hydrochloride Formula: C17H27ClNO2S+ MolecularWeight: 344.91978

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)COC(=O)C2(CCCC2)C3=CSC=C3.Cl

Isomeric SMILES

C[N+]1(CCCCC1)COC(=O)C2(CCCC2)C3=CSC=C3.Cl

InChI

InChI=1S/C17H26NO2S.ClH/c1-18(10-5-2-6-11-18)14-20-16(19)17(8-3-4-9-17)15-7-12-21-13-15;/h7,12-13H,2-6,8-11,14H2,1H3;1H/q+1;