ethyl 1-[1-(2-chlorophenyl)-2-methoxy-2-oxidanylidene-ethyl]-4-ethanoylsulfanyl-2-methylidene-piperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-(2-chlorophenyl)-2-methoxy-2-oxidanylidene-ethyl]-4-ethanoylsulfanyl-2-methylidene-piperidine-3-carboxylate Openeye Name: ethyl 4-acetylsulfanyl-1-[1-(2-chlorophenyl)-2-methoxy-2-oxo-ethyl]-2-methylene-piperidine-3-carboxylate CAS Name: 4-(acetylthio)-1-[1-(2-chlorophenyl)-2-methoxy-2-oxoethyl]-2-methylene-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetylsulfanyl-1-[1-(2-chlorophenyl)-2-methoxy-2-oxoethyl]-2-methylidenepiperidine-3-carboxylate Traditional Name: 4-(acetylthio)-1-[1-(2-chlorophenyl)-2-keto-2-methoxy-ethyl]-2-methylene-nipecotic acid ethyl ester Formula: C20H24ClNO5S MolecularWeight: 425.92626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CCN(C1=C)C(C2=CC=CC=C2Cl)C(=O)OC)SC(=O)C

Isomeric SMILES

CCOC(=O)C1C(CCN(C1=C)C(C2=CC=CC=C2Cl)C(=O)OC)SC(=O)C

InChI

InChI=1S/C20H24ClNO5S/c1-5-27-19(24)17-12(2)22(11-10-16(17)28-13(3)23)18(20(25)26-4)14-8-6-7-9-15(14)21/h6-9,16-18H,2,5,10-11H2,1,3-4H3