2-cyclopentyl-5-diazonio-2-[2-(2,4-dimethoxyphenyl)ethyl]-4-oxidanylidene-3H-pyran-6-olate

Systemtic Name: 2-cyclopentyl-5-diazonio-2-[2-(2,4-dimethoxyphenyl)ethyl]-4-oxidanylidene-3H-pyran-6-olate Openeye Name: 2-cyclopentyl-5-diazonio-2-[2-(2,4-dimethoxyphenyl)ethyl]-4-oxo-3H-pyran-6-olate CAS Name: 2-cyclopentyl-5-diazonio-2-[2-(2,4-dimethoxyphenyl)ethyl]-4-oxo-3H-pyran-6-olate IUPAC Name: 2-cyclopentyl-5-diazonio-2-[2-(2,4-dimethoxyphenyl)ethyl]-4-oxo-3H-pyran-6-olate Traditional Name: 2-cyclopentyl-5-diazonio-2-[2-(2,4-dimethoxyphenyl)ethyl]-4-keto-3H-pyran-6-olate Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CCC2(CC(=O)C(=C(O2)[O-])[N+]#N)C3CCCC3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CCC2(CC(=O)C(=C(O2)[O-])[N+]#N)C3CCCC3)OC

InChI

InChI=1S/C20H24N2O5/c1-25-15-8-7-13(17(11-15)26-2)9-10-20(14-5-3-4-6-14)12-16(23)18(22-21)19(24)27-20/h7-8,11,14H,3-6,9-10,12H2,1-2H3