7-[2-[(E)-2-(3-methanoylphenyl)ethenyl]-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-[(E)-2-(3-methanoylphenyl)ethenyl]-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[2-[(E)-2-(3-formylphenyl)vinyl]-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[2-[(E)-2-(3-formylphenyl)ethenyl]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[2-[(E)-2-(3-formylphenyl)ethenyl]-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-[(E)-2-(3-formylphenyl)vinyl]-5-keto-cyclopentyl]enanthic acid Formula: C21H26O4 MolecularWeight: 342.42874

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(C1C=CC2=CC(=CC=C2)C=O)CCCCCCC(=O)O

Isomeric SMILES

C1CC(=O)C(C1/C=C/C2=CC(=CC=C2)C=O)CCCCCCC(=O)O

InChI

InChI=1S/C21H26O4/c22-15-17-7-5-6-16(14-17)10-11-18-12-13-20(23)19(18)8-3-1-2-4-9-21(24)25/h5-7,10-11,14-15,18-19H,1-4,8-9,12-13H2,(H,24,25)/b11-10+