oxolan-2-ylmethyl 2,7,7-trimethyl-4-(5-methylthiophen-2-yl)-5-oxidanylidene-1,4,4a,6-tetrahydroquinoline-3-carboxylate

Systemtic Name: oxolan-2-ylmethyl 2,7,7-trimethyl-4-(5-methylthiophen-2-yl)-5-oxidanylidene-1,4,4a,6-tetrahydroquinoline-3-carboxylate Openeye Name: tetrahydrofuran-2-ylmethyl 2,7,7-trimethyl-4-(5-methyl-2-thienyl)-5-oxo-1,4,4a,6-tetrahydroquinoline-3-carboxylate CAS Name: 2,7,7-trimethyl-4-(5-methyl-2-thiophenyl)-5-oxo-1,4,4a,6-tetrahydroquinoline-3-carboxylic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl 2,7,7-trimethyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,4a,6-tetrahydroquinoline-3-carboxylate Traditional Name: 5-keto-2,7,7-trimethyl-4-(5-methyl-2-thienyl)-1,4,4a,6-tetrahydroquinoline-3-carboxylic acid tetrahydrofurfuryl ester Formula: C23H29NO4S MolecularWeight: 415.54566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2C3C(=O)CC(C=C3NC(=C2C(=O)OCC4CCCO4)C)(C)C

Isomeric SMILES

CC1=CC=C(S1)C2C3C(=O)CC(C=C3NC(=C2C(=O)OCC4CCCO4)C)(C)C

InChI

InChI=1S/C23H29NO4S/c1-13-7-8-18(29-13)21-19(22(26)28-12-15-6-5-9-27-15)14(2)24-16-10-23(3,4)11-17(25)20(16)21/h7-8,10,15,20-21,24H,5-6,9,11-12H2,1-4H3