6-methoxy-8-oxidanyl-3-(2-oxidanylpropyl)isochromen-1-one

Systemtic Name: 6-methoxy-8-oxidanyl-3-(2-oxidanylpropyl)isochromen-1-one Openeye Name: 8-hydroxy-3-(2-hydroxypropyl)-6-methoxy-isochromen-1-one CAS Name: 8-hydroxy-3-(2-hydroxypropyl)-6-methoxy-2-benzopyran-1-one IUPAC Name: 8-hydroxy-3-(2-hydroxypropyl)-6-methoxyisochromen-1-one Traditional Name: 8-hydroxy-3-(2-hydroxypropyl)-6-methoxy-isocoumarin Formula: C13H14O5 MolecularWeight: 250.24726

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC2=CC(=CC(=C2C(=O)O1)O)OC)O

Isomeric SMILES

CC(CC1=CC2=CC(=CC(=C2C(=O)O1)O)OC)O

InChI

InChI=1S/C13H14O5/c1-7(14)3-10-5-8-4-9(17-2)6-11(15)12(8)13(16)18-10/h4-7,14-15H,3H2,1-2H3