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

Systemtic Name: oxolan-2-ylmethyl 2,7,7-trimethyl-4-(2-methylphenyl)-5-oxidanylidene-1,4,4a,6-tetrahydroquinoline-3-carboxylate Openeye Name: tetrahydrofuran-2-ylmethyl 2,7,7-trimethyl-4-(o-tolyl)-5-oxo-1,4,4a,6-tetrahydroquinoline-3-carboxylate CAS Name: 2,7,7-trimethyl-4-(2-methylphenyl)-5-oxo-1,4,4a,6-tetrahydroquinoline-3-carboxylic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl 2,7,7-trimethyl-4-(2-methylphenyl)-5-oxo-1,4,4a,6-tetrahydroquinoline-3-carboxylate Traditional Name: 5-keto-2,7,7-trimethyl-4-(o-tolyl)-1,4,4a,6-tetrahydroquinoline-3-carboxylic acid tetrahydrofurfuryl ester Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C3C(=O)CC(C=C3NC(=C2C(=O)OCC4CCCO4)C)(C)C

Isomeric SMILES

CC1=CC=CC=C1C2C3C(=O)CC(C=C3NC(=C2C(=O)OCC4CCCO4)C)(C)C

InChI

InChI=1S/C25H31NO4/c1-15-8-5-6-10-18(15)22-21(24(28)30-14-17-9-7-11-29-17)16(2)26-19-12-25(3,4)13-20(27)23(19)22/h5-6,8,10,12,17,22-23,26H,7,9,11,13-14H2,1-4H3