3-[(Z)-1-bromanylbut-1-enyl]isochromen-1-one

Systemtic Name: 3-[(Z)-1-bromanylbut-1-enyl]isochromen-1-one Openeye Name: 3-[(Z)-1-bromobut-1-enyl]isochromen-1-one CAS Name: 3-[(Z)-1-bromobut-1-enyl]-2-benzopyran-1-one IUPAC Name: 3-[(Z)-1-bromobut-1-enyl]isochromen-1-one Traditional Name: 3-[(Z)-1-bromobut-1-enyl]isocoumarin Formula: C13H11BrO2 MolecularWeight: 279.12924

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C1=CC2=CC=CC=C2C(=O)O1)Br

Isomeric SMILES

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

InChI

InChI=1S/C13H11BrO2/c1-2-5-11(14)12-8-9-6-3-4-7-10(9)13(15)16-12/h3-8H,2H2,1H3/b11-5-