O3-(2-ethylsulfanylethyl) O6-methyl 4-(4-ethoxyphenyl)-7-methyl-2-methylidene-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3,6-dicarboxylate

Systemtic Name: O3-(2-ethylsulfanylethyl) O6-methyl 4-(4-ethoxyphenyl)-7-methyl-2-methylidene-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3,6-dicarboxylate Openeye Name: O3-(2-ethylsulfanylethyl) O6-methyl 4-(4-ethoxyphenyl)-7-methyl-2-methylene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3,6-dicarboxylate CAS Name: 4-(4-ethoxyphenyl)-7-methyl-2-methylene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3,6-dicarboxylic acid O3-[2-(ethylthio)ethyl] ester O6-methyl ester IUPAC Name: 3-O-(2-ethylsulfanylethyl) 6-O-methyl 4-(4-ethoxyphenyl)-7-methyl-2-methylidene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3,6-dicarboxylate Traditional Name: 5-keto-7-methyl-2-methylene-4-p-phenetyl-1,3,4,6,7,8-hexahydroquinoline-3,6-dicarboxylic acid O3-[2-(ethylthio)ethyl] ester O6-methyl ester Formula: C26H33NO6S MolecularWeight: 487.60832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C(C(=C)NC3=C2C(=O)C(C(C3)C)C(=O)OC)C(=O)OCCSCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2C(C(=C)NC3=C2C(=O)C(C(C3)C)C(=O)OC)C(=O)OCCSCC

InChI

InChI=1S/C26H33NO6S/c1-6-32-18-10-8-17(9-11-18)22-21(26(30)33-12-13-34-7-2)16(4)27-19-14-15(3)20(25(29)31-5)24(28)23(19)22/h8-11,15,20-22,27H,4,6-7,12-14H2,1-3,5H3