3-[(2-ethanoyl-5-methoxy-3-oxidanyl-phenyl)methyl]-6,8-bis(oxidanyl)-3,4-dihydroisochromen-1-one

Systemtic Name: 3-[(2-ethanoyl-5-methoxy-3-oxidanyl-phenyl)methyl]-6,8-bis(oxidanyl)-3,4-dihydroisochromen-1-one Openeye Name: 3-[(2-acetyl-3-hydroxy-5-methoxy-phenyl)methyl]-6,8-dihydroxy-isochroman-1-one CAS Name: 3-[(2-acetyl-3-hydroxy-5-methoxyphenyl)methyl]-6,8-dihydroxy-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: 3-[(2-acetyl-3-hydroxy-5-methoxyphenyl)methyl]-6,8-dihydroxy-3,4-dihydroisochromen-1-one Traditional Name: 3-(2-acetyl-3-hydroxy-5-methoxy-benzyl)-6,8-dihydroxy-isochroman-1-one Formula: C19H18O7 MolecularWeight: 358.34202

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1CC2CC3=CC(=CC(=C3C(=O)O2)O)O)OC)O

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1CC2CC3=CC(=CC(=C3C(=O)O2)O)O)OC)O

InChI

InChI=1S/C19H18O7/c1-9(20)17-11(4-13(25-2)8-16(17)23)6-14-5-10-3-12(21)7-15(22)18(10)19(24)26-14/h3-4,7-8,14,21-23H,5-6H2,1-2H3