4-oxidanylidene-6-(piperazin-1-ium-1-ylmethyl)pyran-3-olate

Systemtic Name: 4-oxidanylidene-6-(piperazin-1-ium-1-ylmethyl)pyran-3-olate Openeye Name: 4-oxo-6-(piperazin-1-ium-1-ylmethyl)pyran-3-olate CAS Name: 4-oxo-6-(1-piperazin-1-iumylmethyl)-3-pyranolate IUPAC Name: 4-oxo-6-(piperazin-1-ium-1-ylmethyl)pyran-3-olate Traditional Name: 4-keto-6-(piperazin-1-ium-1-ylmethyl)pyran-3-olate Formula: C10H14N2O3 MolecularWeight: 210.22976

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCN1)CC2=CC(=O)C(=CO2)[O-]

Isomeric SMILES

C1C[NH+](CCN1)CC2=CC(=O)C(=CO2)[O-]

InChI

InChI=1S/C10H14N2O3/c13-9-5-8(15-7-10(9)14)6-12-3-1-11-2-4-12/h5,7,11,14H,1-4,6H2