4-[3-[3-[3-methyl-8-(trifluoromethyl)quinolin-4-yl]phenoxy]phenyl]sulfonylbutan-1-ol

Systemtic Name: 4-[3-[3-[3-methyl-8-(trifluoromethyl)quinolin-4-yl]phenoxy]phenyl]sulfonylbutan-1-ol Openeye Name: 4-[3-[3-[3-methyl-8-(trifluoromethyl)-4-quinolyl]phenoxy]phenyl]sulfonylbutan-1-ol CAS Name: 4-[3-[3-[3-methyl-8-(trifluoromethyl)-4-quinolinyl]phenoxy]phenyl]sulfonyl-1-butanol IUPAC Name: 4-[3-[3-[3-methyl-8-(trifluoromethyl)quinolin-4-yl]phenoxy]phenyl]sulfonylbutan-1-ol Traditional Name: 4-[3-[3-[3-methyl-8-(trifluoromethyl)-4-quinolyl]phenoxy]phenyl]sulfonylbutan-1-ol Formula: C27H24F3NO4S MolecularWeight: 515.54397

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1C3=CC(=CC=C3)OC4=CC(=CC=C4)S(=O)(=O)CCCCO)C=CC=C2C(F)(F)F

Isomeric SMILES

CC1=CN=C2C(=C1C3=CC(=CC=C3)OC4=CC(=CC=C4)S(=O)(=O)CCCCO)C=CC=C2C(F)(F)F

InChI

InChI=1S/C27H24F3NO4S/c1-18-17-31-26-23(11-6-12-24(26)27(28,29)30)25(18)19-7-4-8-20(15-19)35-21-9-5-10-22(16-21)36(33,34)14-3-2-13-32/h4-12,15-17,32H,2-3,13-14H2,1H3