3-(4-methylphenoxy)-4-oxidanylidene-cyclohexane-1-carboxylic acid

Systemtic Name: 3-(4-methylphenoxy)-4-oxidanylidene-cyclohexane-1-carboxylic acid Openeye Name: 3-(4-methylphenoxy)-4-oxo-cyclohexanecarboxylic acid CAS Name: 3-(4-methylphenoxy)-4-oxo-1-cyclohexanecarboxylic acid IUPAC Name: 3-(4-methylphenoxy)-4-oxocyclohexane-1-carboxylic acid Traditional Name: 4-keto-3-(4-methylphenoxy)cyclohexanecarboxylic acid Formula: C14H16O4 MolecularWeight: 248.27444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2CC(CCC2=O)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)OC2CC(CCC2=O)C(=O)O

InChI

InChI=1S/C14H16O4/c1-9-2-5-11(6-3-9)18-13-8-10(14(16)17)4-7-12(13)15/h2-3,5-6,10,13H,4,7-8H2,1H3,(H,16,17)