2,3,5-trimethyl-6-(3-oxidanylpropyl)cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2,3,5-trimethyl-6-(3-oxidanylpropyl)cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-(3-hydroxypropyl)-3,5,6-trimethyl-1,4-benzoquinone CAS Name: 2-(3-hydroxypropyl)-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-(3-hydroxypropyl)-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-(3-hydroxypropyl)-3,5,6-trimethyl-p-benzoquinone Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)C)CCCO)C

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)C)CCCO)C

InChI

InChI=1S/C12H16O3/c1-7-8(2)12(15)10(5-4-6-13)9(3)11(7)14/h13H,4-6H2,1-3H3