6,7-dimethoxy-3-[(1R)-1-oxidanylbutyl]isochromen-1-one

Systemtic Name: 6,7-dimethoxy-3-[(1R)-1-oxidanylbutyl]isochromen-1-one Openeye Name: 3-[(1R)-1-hydroxybutyl]-6,7-dimethoxy-isochromen-1-one CAS Name: 3-[(1R)-1-hydroxybutyl]-6,7-dimethoxy-2-benzopyran-1-one IUPAC Name: 3-[(1R)-1-hydroxybutyl]-6,7-dimethoxyisochromen-1-one Traditional Name: 3-[(1R)-1-hydroxybutyl]-6,7-dimethoxy-isocoumarin Formula: C15H18O5 MolecularWeight: 278.30042

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC2=CC(=C(C=C2C(=O)O1)OC)OC)O

Isomeric SMILES

CCC[C@H](C1=CC2=CC(=C(C=C2C(=O)O1)OC)OC)O

InChI

InChI=1S/C15H18O5/c1-4-5-11(16)12-6-9-7-13(18-2)14(19-3)8-10(9)15(17)20-12/h6-8,11,16H,4-5H2,1-3H3/t11-/m1/s1