pentyl (4R)-2,7,7-trimethyl-5-oxidanylidene-4-pyridin-3-yl-3,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: pentyl (4R)-2,7,7-trimethyl-5-oxidanylidene-4-pyridin-3-yl-3,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: pentyl (4R)-2,7,7-trimethyl-5-oxo-4-(3-pyridyl)-3,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: (4R)-2,7,7-trimethyl-5-oxo-4-(3-pyridinyl)-3,4,6,8-tetrahydroquinoline-3-carboxylic acid pentyl ester IUPAC Name: pentyl (4R)-2,7,7-trimethyl-5-oxo-4-pyridin-3-yl-3,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: (4R)-5-keto-2,7,7-trimethyl-4-(3-pyridyl)-3,4,6,8-tetrahydroquinoline-3-carboxylic acid amyl ester Formula: C23H30N2O3 MolecularWeight: 382.4959

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1C(C2=C(CC(CC2=O)(C)C)N=C1C)C3=CN=CC=C3

Isomeric SMILES

CCCCCOC(=O)C1[C@@H](C2=C(CC(CC2=O)(C)C)N=C1C)C3=CN=CC=C3

InChI

InChI=1S/C23H30N2O3/c1-5-6-7-11-28-22(27)19-15(2)25-17-12-23(3,4)13-18(26)21(17)20(19)16-9-8-10-24-14-16/h8-10,14,19-20H,5-7,11-13H2,1-4H3/t19?,20-/m0/s1