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

Systemtic Name: 6-[[[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-ethoxy-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]amino]methylene]-2-ethoxy-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-ethoxy-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-ethoxy-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]amino]methylene]-2-ethoxy-4-nitro-cyclohexa-2,4-dien-1-one Formula: C22H16BrN3O5 MolecularWeight: 482.28354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=CNC2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)Br)C1=O)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=CC(=CNC2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)Br)C1=O)[N+](=O)[O-]

InChI

InChI=1S/C22H16BrN3O5/c1-2-30-20-11-17(26(28)29)9-14(21(20)27)12-24-16-6-7-19-18(10-16)25-22(31-19)13-4-3-5-15(23)8-13/h3-12,24H,2H2,1H3