methyl 2-(2-chlorophenyl)-2-[(3E)-3-(2-ethoxy-2-oxidanylidene-ethylidene)-4-sulfanyl-piperidin-1-yl]ethanoate

Systemtic Name: methyl 2-(2-chlorophenyl)-2-[(3E)-3-(2-ethoxy-2-oxidanylidene-ethylidene)-4-sulfanyl-piperidin-1-yl]ethanoate Openeye Name: methyl 2-(2-chlorophenyl)-2-[(3E)-3-(2-ethoxy-2-oxo-ethylidene)-4-sulfanyl-1-piperidyl]acetate CAS Name: 2-(2-chlorophenyl)-2-[(3E)-3-(2-ethoxy-2-oxoethylidene)-4-mercapto-1-piperidinyl]acetic acid methyl ester IUPAC Name: methyl 2-(2-chlorophenyl)-2-[(3E)-3-(2-ethoxy-2-oxoethylidene)-4-sulfanylpiperidin-1-yl]acetate Traditional Name: 2-(2-chlorophenyl)-2-[(3E)-3-(2-ethoxy-2-keto-ethylidene)-4-mercapto-piperidino]acetic acid methyl ester Formula: C18H22ClNO4S MolecularWeight: 383.88958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C1CN(CCC1S)C(C2=CC=CC=C2Cl)C(=O)OC

Isomeric SMILES

CCOC(=O)/C=C/1\CN(CCC1S)C(C2=CC=CC=C2Cl)C(=O)OC

InChI

InChI=1S/C18H22ClNO4S/c1-3-24-16(21)10-12-11-20(9-8-15(12)25)17(18(22)23-2)13-6-4-5-7-14(13)19/h4-7,10,15,17,25H,3,8-9,11H2,1-2H3/b12-10+