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

Systemtic Name: 7-[(1R,5S)-2-oxidanylidene-5-phenethyl-cyclopentyl]heptanoic acid Openeye Name: 7-[(1R,5S)-2-oxo-5-phenethyl-cyclopentyl]heptanoic acid CAS Name: 7-[(1R,5S)-2-oxo-5-phenethylcyclopentyl]heptanoic acid IUPAC Name: 7-[(1R,5S)-2-oxo-5-phenethylcyclopentyl]heptanoic acid Traditional Name: 7-[(1R,5S)-2-keto-5-phenethyl-cyclopentyl]enanthic acid Formula: C20H28O3 MolecularWeight: 316.43452

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(C1CCC2=CC=CC=C2)CCCCCCC(=O)O

Isomeric SMILES

C1CC(=O)[C@@H]([C@H]1CCC2=CC=CC=C2)CCCCCCC(=O)O

InChI

InChI=1S/C20H28O3/c21-19-15-14-17(13-12-16-8-4-3-5-9-16)18(19)10-6-1-2-7-11-20(22)23/h3-5,8-9,17-18H,1-2,6-7,10-15H2,(H,22,23)/t17-,18+/m0/s1