(Z)-2-diazonio-4-(4,7-dihydro-1,3-dioxepin-2-yl)-1-methoxy-3-oxidanylidene-but-1-en-1-olate

Systemtic Name: (Z)-2-diazonio-4-(4,7-dihydro-1,3-dioxepin-2-yl)-1-methoxy-3-oxidanylidene-but-1-en-1-olate Openeye Name: (Z)-2-diazonio-4-(4,7-dihydro-1,3-dioxepin-2-yl)-1-methoxy-3-oxo-but-1-en-1-olate CAS Name: (Z)-2-diazonio-4-(4,7-dihydro-1,3-dioxepin-2-yl)-1-methoxy-3-oxo-1-buten-1-olate IUPAC Name: (Z)-2-diazonio-4-(4,7-dihydro-1,3-dioxepin-2-yl)-1-methoxy-3-oxobut-1-en-1-olate Traditional Name: (Z)-2-diazonio-4-(4,7-dihydro-1,3-dioxepin-2-yl)-3-keto-1-methoxy-but-1-en-1-olate Formula: C10H12N2O5 MolecularWeight: 240.21268

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C(C(=O)CC1OCC=CCO1)[N+]#N)[O-]

Isomeric SMILES

CO/C(=C(/C(=O)CC1OCC=CCO1)\[N+]#N)/[O-]

InChI

InChI=1S/C10H12N2O5/c1-15-10(14)9(12-11)7(13)6-8-16-4-2-3-5-17-8/h2-3,8H,4-6H2,1H3