(E)-2-diazonio-1-[5-(1-ethoxy-1-oxidanylidene-propan-2-yl)-2-phenoxy-pyridin-4-yl]ethenolate

Systemtic Name: (E)-2-diazonio-1-[5-(1-ethoxy-1-oxidanylidene-propan-2-yl)-2-phenoxy-pyridin-4-yl]ethenolate Openeye Name: (E)-2-diazonio-1-[5-(2-ethoxy-1-methyl-2-oxo-ethyl)-2-phenoxy-4-pyridyl]ethenolate CAS Name: (E)-2-diazonio-1-[5-(1-ethoxy-1-oxopropan-2-yl)-2-phenoxy-4-pyridinyl]ethenolate IUPAC Name: (E)-2-diazonio-1-[5-(1-ethoxy-1-oxopropan-2-yl)-2-phenoxypyridin-4-yl]ethenolate Traditional Name: (E)-2-diazonio-1-[5-(2-ethoxy-2-keto-1-methyl-ethyl)-2-phenoxy-4-pyridyl]ethenolate Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C1=CN=C(C=C1C(=C[N+]#N)[O-])OC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C)C1=CN=C(C=C1/C(=C\[N+]#N)/[O-])OC2=CC=CC=C2

InChI

InChI=1S/C18H17N3O4/c1-3-24-18(23)12(2)15-10-20-17(9-14(15)16(22)11-21-19)25-13-7-5-4-6-8-13/h4-12H,3H2,1-2H3/b16-11+