ethyl 2,7,7-trimethyl-4-(2-methylsulfanylethyl)-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: ethyl 2,7,7-trimethyl-4-(2-methylsulfanylethyl)-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: ethyl 2,7,7-trimethyl-4-(2-methylsulfanylethyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: 2,7,7-trimethyl-4-[2-(methylthio)ethyl]-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,7,7-trimethyl-4-(2-methylsulfanylethyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: 5-keto-2,7,7-trimethyl-4-[2-(methylthio)ethyl]-1,4,6,8-tetrahydroquinoline-3-carboxylic acid ethyl ester Formula: C18H27NO3S MolecularWeight: 337.47688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1CCSC)C(=O)CC(C2)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1CCSC)C(=O)CC(C2)(C)C)C

InChI

InChI=1S/C18H27NO3S/c1-6-22-17(21)15-11(2)19-13-9-18(3,4)10-14(20)16(13)12(15)7-8-23-5/h12,19H,6-10H2,1-5H3