(E)-5-oxidanylidene-5-(2,6,6-trimethylcyclohexen-1-yl)pent-3-enoic acid

Systemtic Name: (E)-5-oxidanylidene-5-(2,6,6-trimethylcyclohexen-1-yl)pent-3-enoic acid Openeye Name: (E)-5-oxo-5-(2,6,6-trimethylcyclohexen-1-yl)pent-3-enoic acid CAS Name: (E)-5-oxo-5-(2,6,6-trimethyl-1-cyclohexenyl)-3-pentenoic acid IUPAC Name: (E)-5-oxo-5-(2,6,6-trimethylcyclohexen-1-yl)pent-3-enoic acid Traditional Name: (E)-5-keto-5-(2,6,6-trimethylcyclohexen-1-yl)pent-3-enoic acid Formula: C14H20O3 MolecularWeight: 236.3068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O3/c1-10-6-5-9-14(2,3)13(10)11(15)7-4-8-12(16)17/h4,7H,5-6,8-9H2,1-3H3,(H,16,17)/b7-4+