1-[2-cyclopropyl-4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-pentyl]quinolin-4-one

Systemtic Name: 1-[2-cyclopropyl-4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-pentyl]quinolin-4-one Openeye Name: 1-[2-cyclopropyl-4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-pentyl]quinolin-4-one CAS Name: 1-[2-cyclopropyl-4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methylpentyl]-4-quinolinone IUPAC Name: 1-[2-cyclopropyl-4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methylpentyl]quinolin-4-one Traditional Name: 1-[2-cyclopropyl-4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-pentyl]-4-quinolone Formula: C25H28FNO3 MolecularWeight: 409.493123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CN1C=CC(=O)C2=CC=CC=C21)(C3CC3)O)C4=C(C=CC(=C4)F)OC

Isomeric SMILES

CC(C)(CC(CN1C=CC(=O)C2=CC=CC=C21)(C3CC3)O)C4=C(C=CC(=C4)F)OC

InChI

InChI=1S/C25H28FNO3/c1-24(2,20-14-18(26)10-11-23(20)30-3)15-25(29,17-8-9-17)16-27-13-12-22(28)19-6-4-5-7-21(19)27/h4-7,10-14,17,29H,8-9,15-16H2,1-3H3