(E)-7-acetyloxy-1-diazonio-3-(7-ethoxy-7-oxidanylidene-heptyl)dodec-1-en-2-olate

Systemtic Name: (E)-7-acetyloxy-1-diazonio-3-(7-ethoxy-7-oxidanylidene-heptyl)dodec-1-en-2-olate Openeye Name: (E)-7-acetoxy-1-diazonio-3-(7-ethoxy-7-oxo-heptyl)dodec-1-en-2-olate CAS Name: (E)-7-acetyloxy-1-diazonio-3-(7-ethoxy-7-oxoheptyl)-1-dodecen-2-olate IUPAC Name: (E)-7-acetyloxy-1-diazonio-3-(7-ethoxy-7-oxoheptyl)dodec-1-en-2-olate Traditional Name: (E)-7-acetoxy-1-diazonio-3-(7-ethoxy-7-keto-heptyl)dodec-1-en-2-olate Formula: C23H40N2O5 MolecularWeight: 424.5741

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CCCCCCC(=O)OCC)C(=C[N+]#N)[O-])OC(=O)C

Isomeric SMILES

CCCCCC(CCCC(CCCCCCC(=O)OCC)/C(=C\[N+]#N)/[O-])OC(=O)C

InChI

InChI=1S/C23H40N2O5/c1-4-6-9-15-21(30-19(3)26)16-12-14-20(22(27)18-25-24)13-10-7-8-11-17-23(28)29-5-2/h18,20-21H,4-17H2,1-3H3/b22-18+