(4R,4aR)-4-(5-bromanyl-2-fluoranyl-phenyl)-2-methyl-3-piperidin-1-ylcarbonyl-4a,6,7,8-tetrahydro-4H-quinolin-5-one

Systemtic Name: (4R,4aR)-4-(5-bromanyl-2-fluoranyl-phenyl)-2-methyl-3-piperidin-1-ylcarbonyl-4a,6,7,8-tetrahydro-4H-quinolin-5-one Openeye Name: (4R,4aR)-4-(5-bromo-2-fluoro-phenyl)-2-methyl-3-(piperidine-1-carbonyl)-4a,6,7,8-tetrahydro-4H-quinolin-5-one CAS Name: (4R,4aR)-4-(5-bromo-2-fluorophenyl)-2-methyl-3-[oxo(1-piperidinyl)methyl]-4a,6,7,8-tetrahydro-4H-quinolin-5-one IUPAC Name: (4R,4aR)-4-(5-bromo-2-fluorophenyl)-2-methyl-3-(piperidine-1-carbonyl)-4a,6,7,8-tetrahydro-4H-quinolin-5-one Traditional Name: (4R,4aR)-4-(5-bromo-2-fluoro-phenyl)-2-methyl-3-(piperidine-1-carbonyl)-4a,6,7,8-tetrahydro-4H-quinolin-5-one Formula: C22H24BrFN2O2 MolecularWeight: 447.340563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=N1)CCCC2=O)C3=C(C=CC(=C3)Br)F)C(=O)N4CCCCC4

Isomeric SMILES

CC1=C([C@@H]([C@@H]2C(=N1)CCCC2=O)C3=C(C=CC(=C3)Br)F)C(=O)N4CCCCC4

InChI

InChI=1S/C22H24BrFN2O2/c1-13-19(22(28)26-10-3-2-4-11-26)20(15-12-14(23)8-9-16(15)24)21-17(25-13)6-5-7-18(21)27/h8-9,12,20-21H,2-7,10-11H2,1H3/t20-,21+/m0/s1