(E)-2,6,6-trimethyl-3-oxidanyl-hept-4-enoic acid

Systemtic Name: (E)-2,6,6-trimethyl-3-oxidanyl-hept-4-enoic acid Openeye Name: (E)-3-hydroxy-2,6,6-trimethyl-hept-4-enoic acid CAS Name: (E)-3-hydroxy-2,6,6-trimethyl-4-heptenoic acid IUPAC Name: (E)-3-hydroxy-2,6,6-trimethylhept-4-enoic acid Traditional Name: (E)-3-hydroxy-2,6,6-trimethyl-hept-4-enoic acid Formula: C10H18O3 MolecularWeight: 186.24812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C=CC(C)(C)C)O)C(=O)O

Isomeric SMILES

CC(C(/C=C/C(C)(C)C)O)C(=O)O

InChI

InChI=1S/C10H18O3/c1-7(9(12)13)8(11)5-6-10(2,3)4/h5-8,11H,1-4H3,(H,12,13)/b6-5+