2-[(2-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-4-nitro-indene-1,3-dione

Systemtic Name: 2-[(2-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-4-nitro-indene-1,3-dione Openeye Name: 2-[(2-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-4-nitro-indane-1,3-dione CAS Name: 2-[(2-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-4-nitroindene-1,3-dione IUPAC Name: 2-[(2-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-4-nitroindene-1,3-dione Traditional Name: 2-(2-bromo-4-hydroxy-5-methoxy-benzylidene)-4-nitro-indane-1,3-quinone Formula: C17H10BrNO6 MolecularWeight: 404.1684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])Br)O

Isomeric SMILES

COC1=C(C=C(C(=C1)C=C2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])Br)O

InChI

InChI=1S/C17H10BrNO6/c1-25-14-6-8(11(18)7-13(14)20)5-10-16(21)9-3-2-4-12(19(23)24)15(9)17(10)22/h2-7,20H,1H3