3-[(E)-1-oxidanylbut-2-enyl]isochromen-1-one

Systemtic Name: 3-[(E)-1-oxidanylbut-2-enyl]isochromen-1-one Openeye Name: 3-[(E)-1-hydroxybut-2-enyl]isochromen-1-one CAS Name: 3-[(E)-1-hydroxybut-2-enyl]-2-benzopyran-1-one IUPAC Name: 3-[(E)-1-hydroxybut-2-enyl]isochromen-1-one Traditional Name: 3-[(E)-1-hydroxybut-2-enyl]isocoumarin Formula: C13H12O3 MolecularWeight: 216.23258

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(C1=CC2=CC=CC=C2C(=O)O1)O

Isomeric SMILES

C/C=C/C(C1=CC2=CC=CC=C2C(=O)O1)O

InChI

InChI=1S/C13H12O3/c1-2-5-11(14)12-8-9-6-3-4-7-10(9)13(15)16-12/h2-8,11,14H,1H3/b5-2+