dimethyl 2-[8-[4-chloranyl-2-(4-fluorophenyl)phenyl]-2-oxidanylidene-octyl]-2-oxidanyl-butanedioate

Systemtic Name: dimethyl 2-[8-[4-chloranyl-2-(4-fluorophenyl)phenyl]-2-oxidanylidene-octyl]-2-oxidanyl-butanedioate Openeye Name: dimethyl 2-[8-[4-chloro-2-(4-fluorophenyl)phenyl]-2-oxo-octyl]-2-hydroxy-butanedioate CAS Name: 2-[8-[4-chloro-2-(4-fluorophenyl)phenyl]-2-oxooctyl]-2-hydroxybutanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[8-[4-chloro-2-(4-fluorophenyl)phenyl]-2-oxooctyl]-2-hydroxybutanedioate Traditional Name: 2-[8-[4-chloro-2-(4-fluorophenyl)phenyl]-2-keto-octyl]-2-hydroxy-succinic acid dimethyl ester Formula: C26H30ClFO6 MolecularWeight: 492.964203

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC(=O)CCCCCCC1=C(C=C(C=C1)Cl)C2=CC=C(C=C2)F)(C(=O)OC)O

Isomeric SMILES

COC(=O)CC(CC(=O)CCCCCCC1=C(C=C(C=C1)Cl)C2=CC=C(C=C2)F)(C(=O)OC)O

InChI

InChI=1S/C26H30ClFO6/c1-33-24(30)17-26(32,25(31)34-2)16-22(29)8-6-4-3-5-7-18-9-12-20(27)15-23(18)19-10-13-21(28)14-11-19/h9-15,32H,3-8,16-17H2,1-2H3