(3R)-6,8-bis(oxidanyl)-3-undecyl-3,4-dihydroisochromen-1-one

Systemtic Name: (3R)-6,8-bis(oxidanyl)-3-undecyl-3,4-dihydroisochromen-1-one Openeye Name: (3R)-6,8-dihydroxy-3-undecyl-isochroman-1-one CAS Name: (3R)-6,8-dihydroxy-3-undecyl-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: (3R)-6,8-dihydroxy-3-undecyl-3,4-dihydroisochromen-1-one Traditional Name: (3R)-6,8-dihydroxy-3-undecyl-isochroman-1-one Formula: C20H30O4 MolecularWeight: 334.4498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1CC2=CC(=CC(=C2C(=O)O1)O)O

Isomeric SMILES

CCCCCCCCCCC[C@@H]1CC2=CC(=CC(=C2C(=O)O1)O)O

InChI

InChI=1S/C20H30O4/c1-2-3-4-5-6-7-8-9-10-11-17-13-15-12-16(21)14-18(22)19(15)20(23)24-17/h12,14,17,21-22H,2-11,13H2,1H3/t17-/m1/s1