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

Systemtic Name: oxolan-2-ylmethyl 2,7,7-trimethyl-5-oxidanylidene-4-pyridin-3-yl-1,4,4a,6-tetrahydroquinoline-3-carboxylate Openeye Name: tetrahydrofuran-2-ylmethyl 2,7,7-trimethyl-5-oxo-4-(3-pyridyl)-1,4,4a,6-tetrahydroquinoline-3-carboxylate CAS Name: 2,7,7-trimethyl-5-oxo-4-(3-pyridinyl)-1,4,4a,6-tetrahydroquinoline-3-carboxylic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl 2,7,7-trimethyl-5-oxo-4-pyridin-3-yl-1,4,4a,6-tetrahydroquinoline-3-carboxylate Traditional Name: 5-keto-2,7,7-trimethyl-4-(3-pyridyl)-1,4,4a,6-tetrahydroquinoline-3-carboxylic acid tetrahydrofurfuryl ester Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=O)CC(C=C2N1)(C)C)C3=CN=CC=C3)C(=O)OCC4CCCO4

Isomeric SMILES

CC1=C(C(C2C(=O)CC(C=C2N1)(C)C)C3=CN=CC=C3)C(=O)OCC4CCCO4

InChI

InChI=1S/C23H28N2O4/c1-14-19(22(27)29-13-16-7-5-9-28-16)20(15-6-4-8-24-12-15)21-17(25-14)10-23(2,3)11-18(21)26/h4,6,8,10,12,16,20-21,25H,5,7,9,11,13H2,1-3H3