(Z)-2-diazonio-3-oxidanylidene-1-(2,4,6-trimethylphenoxy)but-1-en-1-olate

Systemtic Name: (Z)-2-diazonio-3-oxidanylidene-1-(2,4,6-trimethylphenoxy)but-1-en-1-olate Openeye Name: (Z)-2-diazonio-3-oxo-1-(2,4,6-trimethylphenoxy)but-1-en-1-olate CAS Name: (Z)-2-diazonio-3-oxo-1-(2,4,6-trimethylphenoxy)-1-buten-1-olate IUPAC Name: (Z)-2-diazonio-3-oxo-1-(2,4,6-trimethylphenoxy)but-1-en-1-olate Traditional Name: (Z)-2-diazonio-3-keto-1-(2,4,6-trimethylphenoxy)but-1-en-1-olate Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OC(=C(C(=O)C)[N+]#N)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)O/C(=C(/C(=O)C)\[N+]#N)/[O-])C

InChI

InChI=1S/C13H14N2O3/c1-7-5-8(2)12(9(3)6-7)18-13(17)11(15-14)10(4)16/h5-6H,1-4H3