6-[4-phenyl-3-[3-(trifluoromethyl)heptoxycarbonyl]phenoxy]carbonylnaphthalene-2-carboxylic acid

Systemtic Name: 6-[4-phenyl-3-[3-(trifluoromethyl)heptoxycarbonyl]phenoxy]carbonylnaphthalene-2-carboxylic acid Openeye Name: 6-[4-phenyl-3-[3-(trifluoromethyl)heptoxycarbonyl]phenoxy]carbonylnaphthalene-2-carboxylic acid CAS Name: 6-[oxo-[3-[oxo-[3-(trifluoromethyl)heptoxy]methyl]-4-phenylphenoxy]methyl]-2-naphthalenecarboxylic acid IUPAC Name: 6-[4-phenyl-3-[3-(trifluoromethyl)heptoxycarbonyl]phenoxy]carbonylnaphthalene-2-carboxylic acid Traditional Name: 6-[4-phenyl-3-[3-(trifluoromethyl)heptoxycarbonyl]phenoxy]carbonyl-2-naphthoic acid Formula: C33H29F3O6 MolecularWeight: 578.57497

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCOC(=O)C1=C(C=CC(=C1)OC(=O)C2=CC3=C(C=C2)C=C(C=C3)C(=O)O)C4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

CCCCC(CCOC(=O)C1=C(C=CC(=C1)OC(=O)C2=CC3=C(C=C2)C=C(C=C3)C(=O)O)C4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C33H29F3O6/c1-2-3-9-26(33(34,35)36)16-17-41-32(40)29-20-27(14-15-28(29)21-7-5-4-6-8-21)42-31(39)25-13-11-22-18-24(30(37)38)12-10-23(22)19-25/h4-8,10-15,18-20,26H,2-3,9,16-17H2,1H3,(H,37,38)