5-(4-oxidanylhepta-1,6-dien-4-yl)benzene-1,2,3-triol

Systemtic Name: 5-(4-oxidanylhepta-1,6-dien-4-yl)benzene-1,2,3-triol Openeye Name: 5-(1-allyl-1-hydroxy-but-3-enyl)benzene-1,2,3-triol CAS Name: 5-(4-hydroxyhepta-1,6-dien-4-yl)benzene-1,2,3-triol IUPAC Name: 5-(4-hydroxyhepta-1,6-dien-4-yl)benzene-1,2,3-triol Traditional Name: 5-(1-allyl-1-hydroxy-but-3-enyl)pyrogallol Formula: C13H16O4 MolecularWeight: 236.26374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC=C)(C1=CC(=C(C(=C1)O)O)O)O

Isomeric SMILES

C=CCC(CC=C)(C1=CC(=C(C(=C1)O)O)O)O

InChI

InChI=1S/C13H16O4/c1-3-5-13(17,6-4-2)9-7-10(14)12(16)11(15)8-9/h3-4,7-8,14-17H,1-2,5-6H2