N'-(4-cyano-1H-pyrazol-5-yl)-N-(3-morpholin-4-ium-4-ylpropyl)ethanediamide

Systemtic Name: N'-(4-cyano-1H-pyrazol-5-yl)-N-(3-morpholin-4-ium-4-ylpropyl)ethanediamide Openeye Name: N'-(4-cyano-1H-pyrazol-5-yl)-N-(3-morpholin-4-ium-4-ylpropyl)oxamide CAS Name: N'-(4-cyano-1H-pyrazol-5-yl)-N-[3-(4-morpholin-4-iumyl)propyl]oxamide IUPAC Name: N'-(4-cyano-1H-pyrazol-5-yl)-N-(3-morpholin-4-ium-4-ylpropyl)oxamide Traditional Name: N'-(4-cyano-1H-pyrazol-5-yl)-N-(3-morpholin-4-ium-4-ylpropyl)oxamide Formula: C13H19N6O3+ MolecularWeight: 307.32836

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C(=O)NC2=C(C=NN2)C#N

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C(=O)NC2=C(C=NN2)C#N

InChI

InChI=1S/C13H18N6O3/c14-8-10-9-16-18-11(10)17-13(21)12(20)15-2-1-3-19-4-6-22-7-5-19/h9H,1-7H2,(H,15,20)(H2,16,17,18,21)/p+1