methyl 2,7,7-trimethyl-4-(3-methyl-1-benzothiophen-2-yl)-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: methyl 2,7,7-trimethyl-4-(3-methyl-1-benzothiophen-2-yl)-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: methyl 2,7,7-trimethyl-4-(3-methylbenzothiophen-2-yl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: 2,7,7-trimethyl-4-(3-methyl-1-benzothiophen-2-yl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2,7,7-trimethyl-4-(3-methyl-1-benzothiophen-2-yl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: 5-keto-2,7,7-trimethyl-4-(3-methylbenzothiophen-2-yl)-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester Formula: C23H25NO3S MolecularWeight: 395.5145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C3C4=C(CC(CC4=O)(C)C)NC(=C3C(=O)OC)C

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C3C4=C(CC(CC4=O)(C)C)NC(=C3C(=O)OC)C

InChI

InChI=1S/C23H25NO3S/c1-12-14-8-6-7-9-17(14)28-21(12)20-18(22(26)27-5)13(2)24-15-10-23(3,4)11-16(25)19(15)20/h6-9,20,24H,10-11H2,1-5H3