6-methyl-7-[3-methyl-2,3-bis(oxidanyl)butoxy]chromen-2-one

Systemtic Name: 6-methyl-7-[3-methyl-2,3-bis(oxidanyl)butoxy]chromen-2-one Openeye Name: 7-(2,3-dihydroxy-3-methyl-butoxy)-6-methyl-chromen-2-one CAS Name: 7-(2,3-dihydroxy-3-methylbutoxy)-6-methyl-1-benzopyran-2-one IUPAC Name: 7-(2,3-dihydroxy-3-methylbutoxy)-6-methylchromen-2-one Traditional Name: 7-(2,3-dihydroxy-3-methyl-butoxy)-6-methyl-coumarin Formula: C15H18O5 MolecularWeight: 278.30042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=CC(=O)O2)OCC(C(C)(C)O)O

Isomeric SMILES

CC1=C(C=C2C(=C1)C=CC(=O)O2)OCC(C(C)(C)O)O

InChI

InChI=1S/C15H18O5/c1-9-6-10-4-5-14(17)20-12(10)7-11(9)19-8-13(16)15(2,3)18/h4-7,13,16,18H,8H2,1-3H3