3-methyl-4-[(E)-7-oxidanyloct-1-enyl]furan-2,5-dione

Systemtic Name: 3-methyl-4-[(E)-7-oxidanyloct-1-enyl]furan-2,5-dione Openeye Name: 3-[(E)-7-hydroxyoct-1-enyl]-4-methyl-furan-2,5-dione CAS Name: 3-[(E)-7-hydroxyoct-1-enyl]-4-methylfuran-2,5-dione IUPAC Name: 3-[(E)-7-hydroxyoct-1-enyl]-4-methylfuran-2,5-dione Traditional Name: 3-[(E)-7-hydroxyoct-1-enyl]-4-methyl-furan-2,5-quinone Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC1=O)C=CCCCCC(C)O

Isomeric SMILES

CC1=C(C(=O)OC1=O)/C=C/CCCCC(C)O

InChI

InChI=1S/C13H18O4/c1-9(14)7-5-3-4-6-8-11-10(2)12(15)17-13(11)16/h6,8-9,14H,3-5,7H2,1-2H3/b8-6+