(1Z)-2-diazonio-5-(oxan-2-yloxy)-1-oxidanyl-3-oxidanylidene-hepta-1,6-dien-1-olate

Systemtic Name: (1Z)-2-diazonio-5-(oxan-2-yloxy)-1-oxidanyl-3-oxidanylidene-hepta-1,6-dien-1-olate Openeye Name: (1Z)-2-diazonio-1-hydroxy-3-oxo-5-tetrahydropyran-2-yloxy-hepta-1,6-dien-1-olate CAS Name: (1Z)-2-diazonio-1-hydroxy-5-(2-oxanyloxy)-3-oxo-1-hepta-1,6-dienolate IUPAC Name: (1Z)-2-diazonio-1-hydroxy-5-(oxan-2-yloxy)-3-oxohepta-1,6-dien-1-olate Traditional Name: (1Z)-2-diazonio-1-hydroxy-3-keto-5-tetrahydropyran-2-yloxy-hepta-1,6-dien-1-olate Formula: C12H16N2O5 MolecularWeight: 268.26584

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(CC(=O)C(=C(O)[O-])[N+]#N)OC1CCCCO1

Isomeric SMILES

C=CC(CC(=O)/C(=C(/O)\[O-])/[N+]#N)OC1CCCCO1

InChI

InChI=1S/C12H16N2O5/c1-2-8(19-10-5-3-4-6-18-10)7-9(15)11(14-13)12(16)17/h2,8,10H,1,3-7H2,(H-,15,16,17)