(2E)-2-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanyl-3H-inden-1-one

Systemtic Name: (2E)-2-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanyl-3H-inden-1-one Openeye Name: (2E)-2-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-4-hydroxy-indan-1-one CAS Name: (2E)-2-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-4-hydroxy-3H-inden-1-one IUPAC Name: (2E)-2-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-4-hydroxy-3H-inden-1-one Traditional Name: (2E)-2-(3-bromo-4-hydroxy-5-methoxy-benzylidene)-4-hydroxy-indan-1-one Formula: C17H13BrO4 MolecularWeight: 361.18672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2CC3=C(C2=O)C=CC=C3O)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/2\CC3=C(C2=O)C=CC=C3O)Br)O

InChI

InChI=1S/C17H13BrO4/c1-22-15-7-9(6-13(18)17(15)21)5-10-8-12-11(16(10)20)3-2-4-14(12)19/h2-7,19,21H,8H2,1H3/b10-5+