[5-(hydroxymethyl)-2,4,4-trimethyl-3-oxidanylidene-cyclohexen-1-yl] 2,2-dimethylpropanoate

Systemtic Name: [5-(hydroxymethyl)-2,4,4-trimethyl-3-oxidanylidene-cyclohexen-1-yl] 2,2-dimethylpropanoate Openeye Name: [5-(hydroxymethyl)-2,4,4-trimethyl-3-oxo-cyclohexen-1-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [5-(hydroxymethyl)-2,4,4-trimethyl-3-oxo-1-cyclohexenyl] ester IUPAC Name: [5-(hydroxymethyl)-2,4,4-trimethyl-3-oxocyclohexen-1-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid (3-keto-2,4,4-trimethyl-5-methylol-cyclohexen-1-yl) ester Formula: C15H24O4 MolecularWeight: 268.34866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1=O)(C)C)CO)OC(=O)C(C)(C)C

Isomeric SMILES

CC1=C(CC(C(C1=O)(C)C)CO)OC(=O)C(C)(C)C

InChI

InChI=1S/C15H24O4/c1-9-11(19-13(18)14(2,3)4)7-10(8-16)15(5,6)12(9)17/h10,16H,7-8H2,1-6H3