2-bromanyl-6-[[[2-(3-iodanylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-4-methyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 2-bromanyl-6-[[[2-(3-iodanylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-4-methyl-cyclohexa-2,4-dien-1-one Openeye Name: 2-bromo-6-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylene]-4-methyl-cyclohexa-2,4-dien-1-one CAS Name: 2-bromo-6-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-4-methyl-1-cyclohexa-2,4-dienone IUPAC Name: 2-bromo-6-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-4-methylcyclohexa-2,4-dien-1-one Traditional Name: 2-bromo-6-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylene]-4-methyl-cyclohexa-2,4-dien-1-one Formula: C21H14BrIN2O2 MolecularWeight: 533.15653

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNC2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)I)C(=O)C(=C1)Br

Isomeric SMILES

CC1=CC(=CNC2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)I)C(=O)C(=C1)Br

InChI

InChI=1S/C21H14BrIN2O2/c1-12-7-14(20(26)17(22)8-12)11-24-16-5-6-19-18(10-16)25-21(27-19)13-3-2-4-15(23)9-13/h2-11,24H,1H3