2-[4-(2-octyl-3-oxidanylidene-cyclohexen-1-yl)phenyl]propanoic acid

Systemtic Name: 2-[4-(2-octyl-3-oxidanylidene-cyclohexen-1-yl)phenyl]propanoic acid Openeye Name: 2-[4-(2-octyl-3-oxo-cyclohexen-1-yl)phenyl]propanoic acid CAS Name: 2-[4-(2-octyl-3-oxo-1-cyclohexenyl)phenyl]propanoic acid IUPAC Name: 2-[4-(2-octyl-3-oxocyclohexen-1-yl)phenyl]propanoic acid Traditional Name: 2-[4-(3-keto-2-octyl-cyclohexen-1-yl)phenyl]propionic acid Formula: C23H32O3 MolecularWeight: 356.49838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(CCCC1=O)C2=CC=C(C=C2)C(C)C(=O)O

Isomeric SMILES

CCCCCCCCC1=C(CCCC1=O)C2=CC=C(C=C2)C(C)C(=O)O

InChI

InChI=1S/C23H32O3/c1-3-4-5-6-7-8-10-21-20(11-9-12-22(21)24)19-15-13-18(14-16-19)17(2)23(25)26/h13-17H,3-12H2,1-2H3,(H,25,26)