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

Systemtic Name: 4-bromanyl-2-[(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)iminomethyl]-6-nitro-phenolate Openeye Name: 4-bromo-2-[[2-(1-naphthyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-nitro-phenolate CAS Name: 4-bromo-2-[[2-(1-naphthalenyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-nitrophenolate IUPAC Name: 4-bromo-2-[(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)iminomethyl]-6-nitrophenolate Traditional Name: 4-bromo-2-[[2-(1-naphthyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-nitro-phenolate Formula: C24H13BrN3O4- MolecularWeight: 487.28172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=NC4=C(O3)C=CC(=C4)N=CC5=CC(=CC(=C5[O-])[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=NC4=C(O3)C=CC(=C4)N=CC5=CC(=CC(=C5[O-])[N+](=O)[O-])Br

InChI

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