cyclopentyl 2,7,7-trimethyl-5-oxidanylidene-4-pyridin-4-yl-1,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: cyclopentyl 2,7,7-trimethyl-5-oxidanylidene-4-pyridin-4-yl-1,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: cyclopentyl 2,7,7-trimethyl-5-oxo-4-(4-pyridyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: 2,7,7-trimethyl-5-oxo-4-pyridin-4-yl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid cyclopentyl ester IUPAC Name: cyclopentyl 2,7,7-trimethyl-5-oxo-4-pyridin-4-yl-1,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: 5-keto-2,7,7-trimethyl-4-(4-pyridyl)-1,4,6,8-tetrahydroquinoline-3-carboxylic acid cyclopentyl ester Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=NC=C3)C(=O)OC4CCCC4

Isomeric SMILES

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=NC=C3)C(=O)OC4CCCC4

InChI

InChI=1S/C23H28N2O3/c1-14-19(22(27)28-16-6-4-5-7-16)20(15-8-10-24-11-9-15)21-17(25-14)12-23(2,3)13-18(21)26/h8-11,16,20,25H,4-7,12-13H2,1-3H3