2-bromanyl-6-[[3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-bromanyl-6-[[3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-bromo-6-[[3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-bromo-6-[[3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-bromo-6-[[3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-bromo-6-[[3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-4-nitro-phenolate Formula: C22H15BrN3O4- MolecularWeight: 465.2762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)OC(=N2)C3=CC(=CC=C3)N=CC4=CC(=CC(=C4[O-])Br)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)OC(=N2)C3=CC(=CC=C3)N=CC4=CC(=CC(=C4[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C22H16BrN3O4/c1-12-6-19-20(7-13(12)2)30-22(25-19)14-4-3-5-16(8-14)24-11-15-9-17(26(28)29)10-18(23)21(15)27/h3-11,27H,1-2H3/p-1