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

Systemtic Name: (4-methoxyphenyl)methyl 2,7,7-trimethyl-5-oxidanylidene-4-thiophen-3-yl-1,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: (4-methoxyphenyl)methyl 2,7,7-trimethyl-5-oxo-4-(3-thienyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: 2,7,7-trimethyl-5-oxo-4-(3-thiophenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 2,7,7-trimethyl-5-oxo-4-thiophen-3-yl-1,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: 5-keto-2,7,7-trimethyl-4-(3-thienyl)-1,4,6,8-tetrahydroquinoline-3-carboxylic acid p-anisyl ester Formula: C25H27NO4S MolecularWeight: 437.55118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CSC=C3)C(=O)OCC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CSC=C3)C(=O)OCC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H27NO4S/c1-15-21(24(28)30-13-16-5-7-18(29-4)8-6-16)22(17-9-10-31-14-17)23-19(26-15)11-25(2,3)12-20(23)27/h5-10,14,22,26H,11-13H2,1-4H3