3-oxidanylidene-2-[(2,6,6-trimethylcyclohexen-1-yl)methyl]butanoic acid

Systemtic Name: 3-oxidanylidene-2-[(2,6,6-trimethylcyclohexen-1-yl)methyl]butanoic acid Openeye Name: 3-oxo-2-[(2,6,6-trimethylcyclohexen-1-yl)methyl]butanoic acid CAS Name: 3-oxo-2-[(2,6,6-trimethyl-1-cyclohexenyl)methyl]butanoic acid IUPAC Name: 3-oxo-2-[(2,6,6-trimethylcyclohexen-1-yl)methyl]butanoic acid Traditional Name: 3-keto-2-[(2,6,6-trimethylcyclohexen-1-yl)methyl]butyric acid Formula: C14H22O3 MolecularWeight: 238.32268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)CC(C(=O)C)C(=O)O

Isomeric SMILES

CC1=C(C(CCC1)(C)C)CC(C(=O)C)C(=O)O

InChI

InChI=1S/C14H22O3/c1-9-6-5-7-14(3,4)12(9)8-11(10(2)15)13(16)17/h11H,5-8H2,1-4H3,(H,16,17)