4-[3-(4-butylsulfonylphenoxy)phenyl]-3-(phenylmethyl)-8-(trifluoromethyl)quinoline

Systemtic Name: 4-[3-(4-butylsulfonylphenoxy)phenyl]-3-(phenylmethyl)-8-(trifluoromethyl)quinoline Openeye Name: 3-benzyl-4-[3-(4-butylsulfonylphenoxy)phenyl]-8-(trifluoromethyl)quinoline CAS Name: 4-[3-(4-butylsulfonylphenoxy)phenyl]-3-(phenylmethyl)-8-(trifluoromethyl)quinoline IUPAC Name: 3-benzyl-4-[3-(4-butylsulfonylphenoxy)phenyl]-8-(trifluoromethyl)quinoline Traditional Name: 3-benzyl-4-[3-(4-butylsulfonylphenoxy)phenyl]-8-(trifluoromethyl)quinoline Formula: C33H28F3NO3S MolecularWeight: 575.64053

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=CC=C(C=C1)OC2=CC=CC(=C2)C3=C4C=CC=C(C4=NC=C3CC5=CC=CC=C5)C(F)(F)F

Isomeric SMILES

CCCCS(=O)(=O)C1=CC=C(C=C1)OC2=CC=CC(=C2)C3=C4C=CC=C(C4=NC=C3CC5=CC=CC=C5)C(F)(F)F

InChI

InChI=1S/C33H28F3NO3S/c1-2-3-19-41(38,39)28-17-15-26(16-18-28)40-27-12-7-11-24(21-27)31-25(20-23-9-5-4-6-10-23)22-37-32-29(31)13-8-14-30(32)33(34,35)36/h4-18,21-22H,2-3,19-20H2,1H3