5-methoxy-3-(2-oxidanylpropan-2-yl)isochromen-1-one

Systemtic Name: 5-methoxy-3-(2-oxidanylpropan-2-yl)isochromen-1-one Openeye Name: 3-(1-hydroxy-1-methyl-ethyl)-5-methoxy-isochromen-1-one CAS Name: 3-(2-hydroxypropan-2-yl)-5-methoxy-2-benzopyran-1-one IUPAC Name: 3-(2-hydroxypropan-2-yl)-5-methoxyisochromen-1-one Traditional Name: 3-(1-hydroxy-1-methyl-ethyl)-5-methoxy-isocoumarin Formula: C13H14O4 MolecularWeight: 234.24786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC2=C(C=CC=C2OC)C(=O)O1)O

Isomeric SMILES

CC(C)(C1=CC2=C(C=CC=C2OC)C(=O)O1)O

InChI

InChI=1S/C13H14O4/c1-13(2,15)11-7-9-8(12(14)17-11)5-4-6-10(9)16-3/h4-7,15H,1-3H3