6-bromanyl-3-ethanoyl-4-phenyl-isochromen-1-one

Systemtic Name: 6-bromanyl-3-ethanoyl-4-phenyl-isochromen-1-one Openeye Name: 3-acetyl-6-bromo-4-phenyl-isochromen-1-one CAS Name: 3-acetyl-6-bromo-4-phenyl-2-benzopyran-1-one IUPAC Name: 3-acetyl-6-bromo-4-phenylisochromen-1-one Traditional Name: 3-acetyl-6-bromo-4-phenyl-isocoumarin Formula: C17H11BrO3 MolecularWeight: 343.17144

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C2=C(C=CC(=C2)Br)C(=O)O1)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=C(C2=C(C=CC(=C2)Br)C(=O)O1)C3=CC=CC=C3

InChI

InChI=1S/C17H11BrO3/c1-10(19)16-15(11-5-3-2-4-6-11)14-9-12(18)7-8-13(14)17(20)21-16/h2-9H,1H3