2-(4-methylsulfanylphenyl)-2-piperidin-1-yl-ethanoic acid

Systemtic Name: 2-(4-methylsulfanylphenyl)-2-piperidin-1-yl-ethanoic acid Openeye Name: 2-(4-methylsulfanylphenyl)-2-(1-piperidyl)acetic acid CAS Name: 2-[4-(methylthio)phenyl]-2-(1-piperidinyl)acetic acid IUPAC Name: 2-(4-methylsulfanylphenyl)-2-piperidin-1-ylacetic acid Traditional Name: 2-[4-(methylthio)phenyl]-2-piperidino-acetic acid Formula: C14H19NO2S MolecularWeight: 265.37116

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(C(=O)O)N2CCCCC2

Isomeric SMILES

CSC1=CC=C(C=C1)C(C(=O)O)N2CCCCC2

InChI

InChI=1S/C14H19NO2S/c1-18-12-7-5-11(6-8-12)13(14(16)17)15-9-3-2-4-10-15/h5-8,13H,2-4,9-10H2,1H3,(H,16,17)