4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-7-oxidanyl-3,4-dihydrochromen-2-one

Systemtic Name: 4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-7-oxidanyl-3,4-dihydrochromen-2-one Openeye Name: 4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-7-hydroxy-chroman-2-one CAS Name: 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-hydroxy-3,4-dihydro-2H-1-benzopyran-2-one IUPAC Name: 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-hydroxy-3,4-dihydrochromen-2-one Traditional Name: 4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-7-hydroxy-chroman-2-one Formula: C16H13BrO5 MolecularWeight: 365.17542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2CC(=O)OC3=C2C=CC(=C3)O)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C2CC(=O)OC3=C2C=CC(=C3)O)Br)O

InChI

InChI=1S/C16H13BrO5/c1-21-14-5-8(4-12(17)16(14)20)11-7-15(19)22-13-6-9(18)2-3-10(11)13/h2-6,11,18,20H,7H2,1H3