3-[(3-bromanyl-4-oxidanyl-phenyl)methyl]chromen-2-one

Systemtic Name: 3-[(3-bromanyl-4-oxidanyl-phenyl)methyl]chromen-2-one Openeye Name: 3-[(3-bromo-4-hydroxy-phenyl)methyl]chromen-2-one CAS Name: 3-[(3-bromo-4-hydroxyphenyl)methyl]-1-benzopyran-2-one IUPAC Name: 3-[(3-bromo-4-hydroxyphenyl)methyl]chromen-2-one Traditional Name: 3-(3-bromo-4-hydroxy-benzyl)coumarin Formula: C16H11BrO3 MolecularWeight: 331.16074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)CC3=CC(=C(C=C3)O)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)CC3=CC(=C(C=C3)O)Br

InChI

InChI=1S/C16H11BrO3/c17-13-8-10(5-6-14(13)18)7-12-9-11-3-1-2-4-15(11)20-16(12)19/h1-6,8-9,18H,7H2