methyl 2-methylidene-4-(4-methylsulfanylphenyl)-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate

Systemtic Name: methyl 2-methylidene-4-(4-methylsulfanylphenyl)-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: methyl 2-methylene-4-(4-methylsulfanylphenyl)-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 2-methylene-4-[4-(methylthio)phenyl]-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-methylidene-4-(4-methylsulfanylphenyl)-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 5-keto-2-methylene-4-[4-(methylthio)phenyl]-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid methyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C2=C(CCCC2=O)NC1=C)C3=CC=C(C=C3)SC

Isomeric SMILES

COC(=O)C1C(C2=C(CCCC2=O)NC1=C)C3=CC=C(C=C3)SC

InChI

InChI=1S/C19H21NO3S/c1-11-16(19(22)23-2)17(12-7-9-13(24-3)10-8-12)18-14(20-11)5-4-6-15(18)21/h7-10,16-17,20H,1,4-6H2,2-3H3