6-oxidanylidene-4-piperazin-4-ium-1-ylcarbonyl-1H-pyridin-2-olate

Systemtic Name: 6-oxidanylidene-4-piperazin-4-ium-1-ylcarbonyl-1H-pyridin-2-olate Openeye Name: 6-oxo-4-(piperazin-4-ium-1-carbonyl)-1H-pyridin-2-olate CAS Name: 6-oxo-4-[oxo(1-piperazin-4-iumyl)methyl]-1H-pyridin-2-olate IUPAC Name: 6-oxo-4-(piperazin-4-ium-1-carbonyl)-1H-pyridin-2-olate Traditional Name: 6-keto-4-(piperazin-4-ium-1-carbonyl)-1H-pyridin-2-olate Formula: C10H13N3O3 MolecularWeight: 223.22852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)C2=CC(=O)NC(=C2)[O-]

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)C2=CC(=O)NC(=C2)[O-]

InChI

InChI=1S/C10H13N3O3/c14-8-5-7(6-9(15)12-8)10(16)13-3-1-11-2-4-13/h5-6,11H,1-4H2,(H2,12,14,15)