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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)Br)NC=C4C=C(C=C(C4=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)Br)NC=C4C=C(C=C(C4=O)OC)[N+](=O)[O-]

InChI

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