7-[(1R,2R,3S)-3-oxidanyl-5-oxidanylidene-2-phenethyl-cyclopentyl]heptanoic acid

Systemtic Name: 7-[(1R,2R,3S)-3-oxidanyl-5-oxidanylidene-2-phenethyl-cyclopentyl]heptanoic acid Openeye Name: 7-[(1R,2R,3S)-3-hydroxy-5-oxo-2-phenethyl-cyclopentyl]heptanoic acid CAS Name: 7-[(1R,2R,3S)-3-hydroxy-5-oxo-2-phenethylcyclopentyl]heptanoic acid IUPAC Name: 7-[(1R,2R,3S)-3-hydroxy-5-oxo-2-phenethylcyclopentyl]heptanoic acid Traditional Name: 7-[(1R,2R,3S)-3-hydroxy-5-keto-2-phenethyl-cyclopentyl]enanthic acid Formula: C20H28O4 MolecularWeight: 332.43392

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C1=O)CCCCCCC(=O)O)CCC2=CC=CC=C2)O

Isomeric SMILES

C1[C@@H]([C@@H]([C@H](C1=O)CCCCCCC(=O)O)CCC2=CC=CC=C2)O

InChI

InChI=1S/C20H28O4/c21-18-14-19(22)17(13-12-15-8-4-3-5-9-15)16(18)10-6-1-2-7-11-20(23)24/h3-5,8-9,16-17,19,22H,1-2,6-7,10-14H2,(H,23,24)/t16-,17-,19+/m1/s1