(E)-3-oxidanylidene-5-(2,6,6-trimethylcyclohexen-1-yl)pent-4-enoic acid

Systemtic Name: (E)-3-oxidanylidene-5-(2,6,6-trimethylcyclohexen-1-yl)pent-4-enoic acid Openeye Name: (E)-3-oxo-5-(2,6,6-trimethylcyclohexen-1-yl)pent-4-enoic acid CAS Name: (E)-3-oxo-5-(2,6,6-trimethyl-1-cyclohexenyl)-4-pentenoic acid IUPAC Name: (E)-3-oxo-5-(2,6,6-trimethylcyclohexen-1-yl)pent-4-enoic acid Traditional Name: (E)-3-keto-5-(2,6,6-trimethylcyclohexen-1-yl)pent-4-enoic acid Formula: C14H20O3 MolecularWeight: 236.3068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O3/c1-10-5-4-8-14(2,3)12(10)7-6-11(15)9-13(16)17/h6-7H,4-5,8-9H2,1-3H3,(H,16,17)/b7-6+