3-oxidanylidene-5-(2,6,6-trimethylcyclohexen-1-yl)pentanoic acid

Systemtic Name: 3-oxidanylidene-5-(2,6,6-trimethylcyclohexen-1-yl)pentanoic acid Openeye Name: 3-oxo-5-(2,6,6-trimethylcyclohexen-1-yl)pentanoic acid CAS Name: 3-oxo-5-(2,6,6-trimethyl-1-cyclohexenyl)pentanoic acid IUPAC Name: 3-oxo-5-(2,6,6-trimethylcyclohexen-1-yl)pentanoic acid Traditional Name: 3-keto-5-(2,6,6-trimethylcyclohexen-1-yl)valeric acid Formula: C14H22O3 MolecularWeight: 238.32268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22O3/c1-10-5-4-8-14(2,3)12(10)7-6-11(15)9-13(16)17/h4-9H2,1-3H3,(H,16,17)