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

Systemtic Name: 4-bromanyl-6-[[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 4-bromo-6-[[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylene]-2-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 4-bromo-6-[[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 4-bromo-6-[[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-methoxycyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-6-[[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylene]-2-methoxy-cyclohexa-2,4-dien-1-one Formula: C21H14BrIN2O3 MolecularWeight: 549.15593

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=CNC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)I)C1=O)Br

Isomeric SMILES

COC1=CC(=CC(=CNC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)I)C1=O)Br

InChI

InChI=1S/C21H14BrIN2O3/c1-27-19-9-14(22)8-13(20(19)26)11-24-16-6-7-18-17(10-16)25-21(28-18)12-2-4-15(23)5-3-12/h2-11,24H,1H3