6-[[[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-iodanyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-iodanyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]amino]methylene]-2-iodo-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-iodo-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-iodocyclohexa-2,4-dien-1-one Traditional Name: 6-[[[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]amino]methylene]-2-iodo-cyclohexa-2,4-dien-1-one Formula: C20H12BrIN2O2 MolecularWeight: 519.12995

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H12BrIN2O2/c21-14-6-4-12(5-7-14)20-24-17-10-15(8-9-18(17)26-20)23-11-13-2-1-3-16(22)19(13)25/h1-11,23H