(E)-7-[2-[4-(2-methyl-1-oxidanyl-propan-2-yl)phenyl]-3-oxidanyl-cyclopentyl]hept-5-enoic acid

Systemtic Name: (E)-7-[2-[4-(2-methyl-1-oxidanyl-propan-2-yl)phenyl]-3-oxidanyl-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[3-hydroxy-2-[4-(2-hydroxy-1,1-dimethyl-ethyl)phenyl]cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[3-hydroxy-2-[4-(1-hydroxy-2-methylpropan-2-yl)phenyl]cyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[3-hydroxy-2-[4-(1-hydroxy-2-methylpropan-2-yl)phenyl]cyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[3-hydroxy-2-[4-(2-hydroxy-1,1-dimethyl-ethyl)phenyl]cyclopentyl]hept-5-enoic acid Formula: C22H32O4 MolecularWeight: 360.48708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)C1=CC=C(C=C1)C2C(CCC2O)CC=CCCCC(=O)O

Isomeric SMILES

CC(C)(CO)C1=CC=C(C=C1)C2C(CCC2O)C/C=C/CCCC(=O)O

InChI

InChI=1S/C22H32O4/c1-22(2,15-23)18-12-9-17(10-13-18)21-16(11-14-19(21)24)7-5-3-4-6-8-20(25)26/h3,5,9-10,12-13,16,19,21,23-24H,4,6-8,11,14-15H2,1-2H3,(H,25,26)/b5-3+