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

Systemtic Name: 7-[2-[(E)-2-(3-methylphenyl)ethenyl]-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[2-[(E)-2-(m-tolyl)vinyl]-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[2-[(E)-2-(3-methylphenyl)ethenyl]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[2-[(E)-2-(3-methylphenyl)ethenyl]-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-keto-5-[(E)-2-(m-tolyl)vinyl]cyclopentyl]enanthic acid Formula: C21H28O3 MolecularWeight: 328.44522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=CC2CCC(=O)C2CCCCCCC(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)/C=C/C2CCC(=O)C2CCCCCCC(=O)O

InChI

InChI=1S/C21H28O3/c1-16-7-6-8-17(15-16)11-12-18-13-14-20(22)19(18)9-4-2-3-5-10-21(23)24/h6-8,11-12,15,18-19H,2-5,9-10,13-14H2,1H3,(H,23,24)/b12-11+