(1Z)-2-diazonio-7-methyl-1-oxidanyl-3-oxidanylidene-octa-1,6-dien-1-olate

Systemtic Name: (1Z)-2-diazonio-7-methyl-1-oxidanyl-3-oxidanylidene-octa-1,6-dien-1-olate Openeye Name: (1Z)-2-diazonio-1-hydroxy-7-methyl-3-oxo-octa-1,6-dien-1-olate CAS Name: (1Z)-2-diazonio-1-hydroxy-7-methyl-3-oxo-1-octa-1,6-dienolate IUPAC Name: (1Z)-2-diazonio-1-hydroxy-7-methyl-3-oxoocta-1,6-dien-1-olate Traditional Name: (1Z)-2-diazonio-1-hydroxy-3-keto-7-methyl-octa-1,6-dien-1-olate Formula: C9H12N2O3 MolecularWeight: 196.20318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=O)C(=C(O)[O-])[N+]#N)C

Isomeric SMILES

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

InChI

InChI=1S/C9H12N2O3/c1-6(2)4-3-5-7(12)8(11-10)9(13)14/h4H,3,5H2,1-2H3,(H-,12,13,14)