(E)-2-diazonio-2-nitro-1-[(4-phenylmethoxyphenyl)methoxy]ethenolate

Systemtic Name: (E)-2-diazonio-2-nitro-1-[(4-phenylmethoxyphenyl)methoxy]ethenolate Openeye Name: (E)-1-[(4-benzyloxyphenyl)methoxy]-2-diazonio-2-nitro-ethenolate CAS Name: (E)-2-diazonio-2-nitro-1-[(4-phenylmethoxyphenyl)methoxy]ethenolate IUPAC Name: (E)-2-diazonio-2-nitro-1-[(4-phenylmethoxyphenyl)methoxy]ethenolate Traditional Name: (E)-1-(4-benzoxybenzyl)oxy-2-diazonio-2-nitro-ethenolate Formula: C16H13N3O5 MolecularWeight: 327.29152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)COC(=C([N+]#N)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CO/C(=C(\[N+]#N)/[N+](=O)[O-])/[O-]

InChI

InChI=1S/C16H13N3O5/c17-18-15(19(21)22)16(20)24-11-13-6-8-14(9-7-13)23-10-12-4-2-1-3-5-12/h1-9H,10-11H2/b16-15+