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

Systemtic Name: [2,3-bis(fluoranyl)phenyl] 2-chloranyl-4-(4-heptoxyphenyl)-3-methyl-butanoate Openeye Name: (2,3-difluorophenyl) 2-chloro-4-(4-heptoxyphenyl)-3-methyl-butanoate CAS Name: 2-chloro-4-(4-heptoxyphenyl)-3-methylbutanoic acid (2,3-difluorophenyl) ester IUPAC Name: (2,3-difluorophenyl) 2-chloro-4-(4-heptoxyphenyl)-3-methylbutanoate Traditional Name: 2-chloro-4-(4-heptoxyphenyl)-3-methyl-butyric acid (2,3-difluorophenyl) ester Formula: C24H29ClF2O3 MolecularWeight: 438.935066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)CC(C)C(C(=O)OC2=C(C(=CC=C2)F)F)Cl

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)CC(C)C(C(=O)OC2=C(C(=CC=C2)F)F)Cl

InChI

InChI=1S/C24H29ClF2O3/c1-3-4-5-6-7-15-29-19-13-11-18(12-14-19)16-17(2)22(25)24(28)30-21-10-8-9-20(26)23(21)27/h8-14,17,22H,3-7,15-16H2,1-2H3