2,2,3-trimethyl-3-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]cyclopentane-1-carboxylic acid

Systemtic Name: 2,2,3-trimethyl-3-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]cyclopentane-1-carboxylic acid Openeye Name: 3-[(E)-3-hydroxy-3-oxo-prop-1-enyl]-2,2,3-trimethyl-cyclopentanecarboxylic acid CAS Name: 3-[(E)-3-hydroxy-3-oxoprop-1-enyl]-2,2,3-trimethyl-1-cyclopentanecarboxylic acid IUPAC Name: 3-[(E)-3-hydroxy-3-oxoprop-1-enyl]-2,2,3-trimethylcyclopentane-1-carboxylic acid Traditional Name: 3-[(E)-3-hydroxy-3-keto-prop-1-enyl]-2,2,3-trimethyl-cyclopentanecarboxylic acid Formula: C12H18O4 MolecularWeight: 226.26892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18O4/c1-11(2)8(10(15)16)4-6-12(11,3)7-5-9(13)14/h5,7-8H,4,6H2,1-3H3,(H,13,14)(H,15,16)/b7-5+