7-ethanoyl-3-methyl-6,8-bis(oxidanyl)isochromen-1-one

Systemtic Name: 7-ethanoyl-3-methyl-6,8-bis(oxidanyl)isochromen-1-one Openeye Name: 7-acetyl-6,8-dihydroxy-3-methyl-isochromen-1-one CAS Name: 7-acetyl-6,8-dihydroxy-3-methyl-2-benzopyran-1-one IUPAC Name: 7-acetyl-6,8-dihydroxy-3-methylisochromen-1-one Traditional Name: 7-acetyl-6,8-dihydroxy-3-methyl-isocoumarin Formula: C12H10O5 MolecularWeight: 234.2048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(C(=C2C(=O)O1)O)C(=O)C)O

Isomeric SMILES

CC1=CC2=CC(=C(C(=C2C(=O)O1)O)C(=O)C)O

InChI

InChI=1S/C12H10O5/c1-5-3-7-4-8(14)9(6(2)13)11(15)10(7)12(16)17-5/h3-4,14-15H,1-2H3