(E)-7-[2,4-bis(chloranyl)-6-cycloheptyl-phenyl]-5-oxidanyl-3-oxidanylidene-hept-6-enoic acid

Systemtic Name: (E)-7-[2,4-bis(chloranyl)-6-cycloheptyl-phenyl]-5-oxidanyl-3-oxidanylidene-hept-6-enoic acid Openeye Name: (E)-7-(2,4-dichloro-6-cycloheptyl-phenyl)-5-hydroxy-3-oxo-hept-6-enoic acid CAS Name: (E)-7-(2,4-dichloro-6-cycloheptylphenyl)-5-hydroxy-3-oxo-6-heptenoic acid IUPAC Name: (E)-7-(2,4-dichloro-6-cycloheptylphenyl)-5-hydroxy-3-oxohept-6-enoic acid Traditional Name: (E)-7-(2,4-dichloro-6-cycloheptyl-phenyl)-5-hydroxy-3-keto-hept-6-enoic acid Formula: C20H24Cl2O4 MolecularWeight: 399.30816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C2=CC(=CC(=C2C=CC(CC(=O)CC(=O)O)O)Cl)Cl

Isomeric SMILES

C1CCCC(CC1)C2=CC(=CC(=C2/C=C/C(CC(=O)CC(=O)O)O)Cl)Cl

InChI

InChI=1S/C20H24Cl2O4/c21-14-9-18(13-5-3-1-2-4-6-13)17(19(22)10-14)8-7-15(23)11-16(24)12-20(25)26/h7-10,13,15,23H,1-6,11-12H2,(H,25,26)/b8-7+