1-[2-methyl-4,6-bis(oxidanyl)-2,3-dihydro-1-benzofuran-7-yl]butan-1-one

Systemtic Name: 1-[2-methyl-4,6-bis(oxidanyl)-2,3-dihydro-1-benzofuran-7-yl]butan-1-one Openeye Name: 1-(4,6-dihydroxy-2-methyl-2,3-dihydrobenzofuran-7-yl)butan-1-one CAS Name: 1-(4,6-dihydroxy-2-methyl-2,3-dihydrobenzofuran-7-yl)-1-butanone IUPAC Name: 1-(4,6-dihydroxy-2-methyl-2,3-dihydro-1-benzofuran-7-yl)butan-1-one Traditional Name: 1-(4,6-dihydroxy-2-methyl-coumaran-7-yl)butan-1-one Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C2C(=C(C=C1O)O)CC(O2)C

Isomeric SMILES

CCCC(=O)C1=C2C(=C(C=C1O)O)CC(O2)C

InChI

InChI=1S/C13H16O4/c1-3-4-9(14)12-11(16)6-10(15)8-5-7(2)17-13(8)12/h6-7,15-16H,3-5H2,1-2H3