[2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-(2,5-dimethylphenyl)sulfanylethanoate

Systemtic Name: [2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-(2,5-dimethylphenyl)sulfanylethanoate Openeye Name: [2-(2-ethyl-1-piperidyl)-2-oxo-ethyl] 2-(2,5-dimethylphenyl)sulfanylacetate CAS Name: 2-[(2,5-dimethylphenyl)thio]acetic acid [2-(2-ethyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(2-ethylpiperidin-1-yl)-2-oxoethyl] 2-(2,5-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(2,5-dimethylphenyl)thio]acetic acid [2-(2-ethylpiperidino)-2-keto-ethyl] ester Formula: C19H27NO3S MolecularWeight: 349.48758

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)COC(=O)CSC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCC1CCCCN1C(=O)COC(=O)CSC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C19H27NO3S/c1-4-16-7-5-6-10-20(16)18(21)12-23-19(22)13-24-17-11-14(2)8-9-15(17)3/h8-9,11,16H,4-7,10,12-13H2,1-3H3