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

Systemtic Name: 2-bromanyl-6-[[[2-(3-iodanylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 2-bromo-6-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 2-bromo-6-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 2-bromo-6-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 2-bromo-6-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C20H11BrIN3O4 MolecularWeight: 564.12751

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)C2=NC3=C(O2)C=CC(=C3)NC=C4C=C(C=C(C4=O)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)I)C2=NC3=C(O2)C=CC(=C3)NC=C4C=C(C=C(C4=O)Br)[N+](=O)[O-]

InChI

InChI=1S/C20H11BrIN3O4/c21-16-9-15(25(27)28)7-12(19(16)26)10-23-14-4-5-18-17(8-14)24-20(29-18)11-2-1-3-13(22)6-11/h1-10,23H