1-[[4-fluoranyl-3-[4-[(2R)-2-methylazetidin-2-yl]carbonylpiperazin-1-yl]carbonyl-phenyl]methyl]quinolin-4-one

Systemtic Name: 1-[[4-fluoranyl-3-[4-[(2R)-2-methylazetidin-2-yl]carbonylpiperazin-1-yl]carbonyl-phenyl]methyl]quinolin-4-one Openeye Name: 1-[[4-fluoro-3-[4-[(2R)-2-methylazetidine-2-carbonyl]piperazine-1-carbonyl]phenyl]methyl]quinolin-4-one CAS Name: 1-[[4-fluoro-3-[[4-[[(2R)-2-methyl-2-azetidinyl]-oxomethyl]-1-piperazinyl]-oxomethyl]phenyl]methyl]-4-quinolinone IUPAC Name: 1-[[4-fluoro-3-[4-[(2R)-2-methylazetidine-2-carbonyl]piperazine-1-carbonyl]phenyl]methyl]quinolin-4-one Traditional Name: 1-[4-fluoro-3-[4-[(2R)-2-methylazetidine-2-carbonyl]piperazine-1-carbonyl]benzyl]-4-quinolone Formula: C26H27FN4O3 MolecularWeight: 462.515983

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN1)C(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)CN4C=CC(=O)C5=CC=CC=C54)F

Isomeric SMILES

C[C@@]1(CCN1)C(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)CN4C=CC(=O)C5=CC=CC=C54)F

InChI

InChI=1S/C26H27FN4O3/c1-26(9-10-28-26)25(34)30-14-12-29(13-15-30)24(33)20-16-18(6-7-21(20)27)17-31-11-8-23(32)19-4-2-3-5-22(19)31/h2-8,11,16,28H,9-10,12-15,17H2,1H3/t26-/m1/s1