ethyl 2-[1-(phenylmethyl)piperidin-4-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[1-(phenylmethyl)piperidin-4-yl]sulfanylethanoate Openeye Name: ethyl 2-[(1-benzyl-4-piperidyl)sulfanyl]acetate CAS Name: 2-[[1-(phenylmethyl)-4-piperidinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(1-benzylpiperidin-4-yl)sulfanylacetate Traditional Name: 2-[(1-benzyl-4-piperidyl)thio]acetic acid ethyl ester Formula: C16H23NO2S MolecularWeight: 293.42432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1CCN(CC1)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CSC1CCN(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C16H23NO2S/c1-2-19-16(18)13-20-15-8-10-17(11-9-15)12-14-6-4-3-5-7-14/h3-7,15H,2,8-13H2,1H3