[4-[2,3-bis(fluoranyl)-4-octoxy-phenyl]phenyl] 3-cyclopentylbenzoate

Systemtic Name: [4-[2,3-bis(fluoranyl)-4-octoxy-phenyl]phenyl] 3-cyclopentylbenzoate Openeye Name: [4-(2,3-difluoro-4-octoxy-phenyl)phenyl] 3-cyclopentylbenzoate CAS Name: 3-cyclopentylbenzoic acid [4-(2,3-difluoro-4-octoxyphenyl)phenyl] ester IUPAC Name: [4-(2,3-difluoro-4-octoxyphenyl)phenyl] 3-cyclopentylbenzoate Traditional Name: 3-cyclopentylbenzoic acid [4-(2,3-difluoro-4-octoxy-phenyl)phenyl] ester Formula: C32H31F2O3 MolecularWeight: 501.583546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C(=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=CC(=C3)[C]4[CH][CH][CH][CH]4)F)F

Isomeric SMILES

CCCCCCCCOC1=C(C(=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=CC(=C3)[C]4[CH][CH][CH][CH]4)F)F

InChI

InChI=1S/C32H31F2O3/c1-2-3-4-5-6-9-21-36-29-20-19-28(30(33)31(29)34)24-15-17-27(18-16-24)37-32(35)26-14-10-13-25(22-26)23-11-7-8-12-23/h7-8,10-20,22H,2-6,9,21H2,1H3