(E)-3-oxidanyl-2-(2-oxidanylidenecyclopentyl)-2-(2-oxidanyl-3-phenoxy-propoxy)hept-4-enoic acid

Systemtic Name: (E)-3-oxidanyl-2-(2-oxidanylidenecyclopentyl)-2-(2-oxidanyl-3-phenoxy-propoxy)hept-4-enoic acid Openeye Name: (E)-3-hydroxy-2-(2-hydroxy-3-phenoxy-propoxy)-2-(2-oxocyclopentyl)hept-4-enoic acid CAS Name: (E)-3-hydroxy-2-(2-hydroxy-3-phenoxypropoxy)-2-(2-oxocyclopentyl)-4-heptenoic acid IUPAC Name: (E)-3-hydroxy-2-(2-hydroxy-3-phenoxypropoxy)-2-(2-oxocyclopentyl)hept-4-enoic acid Traditional Name: (E)-3-hydroxy-2-(2-hydroxy-3-phenoxy-propoxy)-2-(2-ketocyclopentyl)hept-4-enoic acid Formula: C21H28O7 MolecularWeight: 392.44282

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(C(C1CCCC1=O)(C(=O)O)OCC(COC2=CC=CC=C2)O)O

Isomeric SMILES

CC/C=C/C(C(C1CCCC1=O)(C(=O)O)OCC(COC2=CC=CC=C2)O)O

InChI

InChI=1S/C21H28O7/c1-2-3-12-19(24)21(20(25)26,17-10-7-11-18(17)23)28-14-15(22)13-27-16-8-5-4-6-9-16/h3-6,8-9,12,15,17,19,22,24H,2,7,10-11,13-14H2,1H3,(H,25,26)/b12-3+