(4R,4aS)-N-(4-fluorophenyl)-2-methyl-5-oxidanylidene-4-pyridin-4-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxamide

Systemtic Name: (4R,4aS)-N-(4-fluorophenyl)-2-methyl-5-oxidanylidene-4-pyridin-4-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxamide Openeye Name: (4R,4aS)-N-(4-fluorophenyl)-2-methyl-5-oxo-4-(4-pyridyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxamide CAS Name: (4R,4aS)-N-(4-fluorophenyl)-2-methyl-5-oxo-4-pyridin-4-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxamide IUPAC Name: (4R,4aS)-N-(4-fluorophenyl)-2-methyl-5-oxo-4-pyridin-4-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxamide Traditional Name: (4R,4aS)-N-(4-fluorophenyl)-5-keto-2-methyl-4-(4-pyridyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxamide Formula: C22H20FN3O2 MolecularWeight: 377.411503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=N1)CCCC2=O)C3=CC=NC=C3)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

CC1=C([C@H]([C@H]2C(=N1)CCCC2=O)C3=CC=NC=C3)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C22H20FN3O2/c1-13-19(22(28)26-16-7-5-15(23)6-8-16)20(14-9-11-24-12-10-14)21-17(25-13)3-2-4-18(21)27/h5-12,20-21H,2-4H2,1H3,(H,26,28)/t20-,21+/m1/s1