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

Systemtic Name: 2-[[4-(1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-bromanyl-4-nitro-phenolate Openeye Name: 2-[[4-(1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-bromo-4-nitro-phenolate CAS Name: 2-[[4-(1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-bromo-4-nitrophenolate IUPAC Name: 2-[[4-(1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-bromo-4-nitrophenolate Traditional Name: 2-[[4-(1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-bromo-4-nitro-phenolate Formula: C20H11BrN3O4- MolecularWeight: 437.22304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)N=CC4=CC(=CC(=C4[O-])Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)N=CC4=CC(=CC(=C4[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C20H12BrN3O4/c21-16-10-15(24(26)27)9-13(19(16)25)11-22-14-7-5-12(6-8-14)20-23-17-3-1-2-4-18(17)28-20/h1-11,25H/p-1