3-[3,4-bis(oxidanyl)phenyl]-4-methyl-8-oxidanyl-isochromen-1-one

Systemtic Name: 3-[3,4-bis(oxidanyl)phenyl]-4-methyl-8-oxidanyl-isochromen-1-one Openeye Name: 3-(3,4-dihydroxyphenyl)-8-hydroxy-4-methyl-isochromen-1-one CAS Name: 3-(3,4-dihydroxyphenyl)-8-hydroxy-4-methyl-2-benzopyran-1-one IUPAC Name: 3-(3,4-dihydroxyphenyl)-8-hydroxy-4-methylisochromen-1-one Traditional Name: 3-(3,4-dihydroxyphenyl)-8-hydroxy-4-methyl-isocoumarin Formula: C16H12O5 MolecularWeight: 284.26348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=O)C2=C1C=CC=C2O)C3=CC(=C(C=C3)O)O

Isomeric SMILES

CC1=C(OC(=O)C2=C1C=CC=C2O)C3=CC(=C(C=C3)O)O

InChI

InChI=1S/C16H12O5/c1-8-10-3-2-4-12(18)14(10)16(20)21-15(8)9-5-6-11(17)13(19)7-9/h2-7,17-19H,1H3