5-[(2E)-3,7-dimethylocta-2,6-dienyl]-4,6-bis(oxidanyl)-1-benzofuran-3-one

Systemtic Name: 5-[(2E)-3,7-dimethylocta-2,6-dienyl]-4,6-bis(oxidanyl)-1-benzofuran-3-one Openeye Name: 5-[(2E)-3,7-dimethylocta-2,6-dienyl]-4,6-dihydroxy-benzofuran-3-one CAS Name: 5-[(2E)-3,7-dimethylocta-2,6-dienyl]-4,6-dihydroxy-3-benzofuranone IUPAC Name: 5-[(2E)-3,7-dimethylocta-2,6-dienyl]-4,6-dihydroxy-1-benzofuran-3-one Traditional Name: 5-[(2E)-3,7-dimethylocta-2,6-dienyl]-4,6-dihydroxy-coumaran-3-one Formula: C18H22O4 MolecularWeight: 302.36488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCC1=C(C=C2C(=C1O)C(=O)CO2)O)C)C

Isomeric SMILES

CC(=CCC/C(=C/CC1=C(C=C2C(=C1O)C(=O)CO2)O)/C)C

InChI

InChI=1S/C18H22O4/c1-11(2)5-4-6-12(3)7-8-13-14(19)9-16-17(18(13)21)15(20)10-22-16/h5,7,9,19,21H,4,6,8,10H2,1-3H3/b12-7+