[(2R)-oxolan-2-yl]methyl (4R,4aS)-2-methyl-5-oxidanylidene-4-pyridin-4-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate

Systemtic Name: [(2R)-oxolan-2-yl]methyl (4R,4aS)-2-methyl-5-oxidanylidene-4-pyridin-4-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: [(2R)-tetrahydrofuran-2-yl]methyl (4R,4aS)-2-methyl-5-oxo-4-(4-pyridyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4R,4aS)-2-methyl-5-oxo-4-pyridin-4-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid [(2R)-2-oxolanyl]methyl ester IUPAC Name: [(2R)-oxolan-2-yl]methyl (4R,4aS)-2-methyl-5-oxo-4-pyridin-4-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4R,4aS)-5-keto-2-methyl-4-(4-pyridyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid [(2R)-tetrahydrofuran-2-yl]methyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=N1)CCCC2=O)C3=CC=NC=C3)C(=O)OCC4CCCO4

Isomeric SMILES

CC1=C([C@H]([C@H]2C(=N1)CCCC2=O)C3=CC=NC=C3)C(=O)OC[C@H]4CCCO4

InChI

InChI=1S/C21H24N2O4/c1-13-18(21(25)27-12-15-4-3-11-26-15)19(14-7-9-22-10-8-14)20-16(23-13)5-2-6-17(20)24/h7-10,15,19-20H,2-6,11-12H2,1H3/t15-,19-,20+/m1/s1