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

Systemtic Name: 4-bromanyl-2-[(2-naphthalen-2-yl-1,3-benzoxazol-6-yl)iminomethyl]-6-nitro-phenolate Openeye Name: 4-bromo-2-[[2-(2-naphthyl)-1,3-benzoxazol-6-yl]iminomethyl]-6-nitro-phenolate CAS Name: 4-bromo-2-[[2-(2-naphthalenyl)-1,3-benzoxazol-6-yl]iminomethyl]-6-nitrophenolate IUPAC Name: 4-bromo-2-[(2-naphthalen-2-yl-1,3-benzoxazol-6-yl)iminomethyl]-6-nitrophenolate Traditional Name: 4-bromo-2-[[2-(2-naphthyl)-1,3-benzoxazol-6-yl]iminomethyl]-6-nitro-phenolate Formula: C24H13BrN3O4- MolecularWeight: 487.28172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3=NC4=C(O3)C=C(C=C4)N=CC5=CC(=CC(=C5[O-])[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3=NC4=C(O3)C=C(C=C4)N=CC5=CC(=CC(=C5[O-])[N+](=O)[O-])Br

InChI

InChI=1S/C24H14BrN3O4/c25-18-10-17(23(29)21(11-18)28(30)31)13-26-19-7-8-20-22(12-19)32-24(27-20)16-6-5-14-3-1-2-4-15(14)9-16/h1-13,29H/p-1