(E)-7-[5-(4-fluorophenyl)-7,7-dimethyl-benzo[7]annulen-6-yl]-3,5-bis(oxidanyl)hept-6-enoic acid

Systemtic Name: (E)-7-[5-(4-fluorophenyl)-7,7-dimethyl-benzo[7]annulen-6-yl]-3,5-bis(oxidanyl)hept-6-enoic acid Openeye Name: (E)-7-[5-(4-fluorophenyl)-7,7-dimethyl-benzo[7]annulen-6-yl]-3,5-dihydroxy-hept-6-enoic acid CAS Name: (E)-7-[5-(4-fluorophenyl)-7,7-dimethyl-6-benzo[7]annulenyl]-3,5-dihydroxy-6-heptenoic acid IUPAC Name: (E)-7-[5-(4-fluorophenyl)-7,7-dimethylbenzo[7]annulen-6-yl]-3,5-dihydroxyhept-6-enoic acid Traditional Name: (E)-7-[5-(4-fluorophenyl)-7,7-dimethyl-benzocyclohepten-6-yl]-3,5-dihydroxy-hept-6-enoic acid Formula: C26H27FO4 MolecularWeight: 422.488583

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC2=CC=CC=C2C(=C1C=CC(CC(CC(=O)O)O)O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1(C=CC2=CC=CC=C2C(=C1/C=C/C(CC(CC(=O)O)O)O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C26H27FO4/c1-26(2)14-13-17-5-3-4-6-22(17)25(18-7-9-19(27)10-8-18)23(26)12-11-20(28)15-21(29)16-24(30)31/h3-14,20-21,28-29H,15-16H2,1-2H3,(H,30,31)/b12-11+