3-[4,4-dimethyl-1,3-bis(3-methylbut-2-enyl)-2-oxidanylidene-cyclohexyl]propanoic acid

Systemtic Name: 3-[4,4-dimethyl-1,3-bis(3-methylbut-2-enyl)-2-oxidanylidene-cyclohexyl]propanoic acid Openeye Name: 3-[4,4-dimethyl-1,3-bis(3-methylbut-2-enyl)-2-oxo-cyclohexyl]propanoic acid CAS Name: 3-[4,4-dimethyl-1,3-bis(3-methylbut-2-enyl)-2-oxocyclohexyl]propanoic acid IUPAC Name: 3-[4,4-dimethyl-1,3-bis(3-methylbut-2-enyl)-2-oxocyclohexyl]propanoic acid Traditional Name: 3-[2-keto-4,4-dimethyl-1,3-bis(3-methylbut-2-enyl)cyclohexyl]propionic acid Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1C(=O)C(CCC1(C)C)(CCC(=O)O)CC=C(C)C)C

Isomeric SMILES

CC(=CCC1C(=O)C(CCC1(C)C)(CCC(=O)O)CC=C(C)C)C

InChI

InChI=1S/C21H34O3/c1-15(2)7-8-17-19(24)21(11-9-16(3)4,12-10-18(22)23)14-13-20(17,5)6/h7,9,17H,8,10-14H2,1-6H3,(H,22,23)