2-(2-piperidin-4-ylethylsulfanyl)cyclopentene-1-carboxylic acid

Systemtic Name: 2-(2-piperidin-4-ylethylsulfanyl)cyclopentene-1-carboxylic acid Openeye Name: 2-[2-(4-piperidyl)ethylsulfanyl]cyclopentene-1-carboxylic acid CAS Name: 2-[2-(4-piperidinyl)ethylthio]-1-cyclopentenecarboxylic acid IUPAC Name: 2-(2-piperidin-4-ylethylsulfanyl)cyclopentene-1-carboxylic acid Traditional Name: 2-[2-(4-piperidyl)ethylthio]cyclopentene-1-carboxylic acid Formula: C13H21NO2S MolecularWeight: 255.37634

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C1)SCCC2CCNCC2)C(=O)O

Isomeric SMILES

C1CC(=C(C1)SCCC2CCNCC2)C(=O)O

InChI

InChI=1S/C13H21NO2S/c15-13(16)11-2-1-3-12(11)17-9-6-10-4-7-14-8-5-10/h10,14H,1-9H2,(H,15,16)