[2,3-bis(fluoranyl)-4-(4-hexoxyphenyl)phenyl] 2-chloranyl-3-methyl-butanoate

Systemtic Name: [2,3-bis(fluoranyl)-4-(4-hexoxyphenyl)phenyl] 2-chloranyl-3-methyl-butanoate Openeye Name: [2,3-difluoro-4-(4-hexoxyphenyl)phenyl] 2-chloro-3-methyl-butanoate CAS Name: 2-chloro-3-methylbutanoic acid [2,3-difluoro-4-(4-hexoxyphenyl)phenyl] ester IUPAC Name: [2,3-difluoro-4-(4-hexoxyphenyl)phenyl] 2-chloro-3-methylbutanoate Traditional Name: 2-chloro-3-methyl-butyric acid [2,3-difluoro-4-(4-hexoxyphenyl)phenyl] ester Formula: C23H27ClF2O3 MolecularWeight: 424.908486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)OC(=O)C(C(C)C)Cl)F)F

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)OC(=O)C(C(C)C)Cl)F)F

InChI

InChI=1S/C23H27ClF2O3/c1-4-5-6-7-14-28-17-10-8-16(9-11-17)18-12-13-19(22(26)21(18)25)29-23(27)20(24)15(2)3/h8-13,15,20H,4-7,14H2,1-3H3