3-azanyl-N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-[1-(2-amino-2-oxo-ethyl)piperidin-1-ium-4-yl]pyrazine-2-carboxamide CAS Name: 3-amino-N-[1-(2-amino-2-oxoethyl)-4-piperidin-1-iumyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-[1-(2-amino-2-oxoethyl)piperidin-1-ium-4-yl]pyrazine-2-carboxamide Traditional Name: 3-amino-N-[1-(2-amino-2-keto-ethyl)piperidin-1-ium-4-yl]pyrazinamide Formula: C12H19N6O2+ MolecularWeight: 279.31826

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=NC=CN=C2N)CC(=O)N

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=NC=CN=C2N)CC(=O)N

InChI

InChI=1S/C12H18N6O2/c13-9(19)7-18-5-1-8(2-6-18)17-12(20)10-11(14)16-4-3-15-10/h3-4,8H,1-2,5-7H2,(H2,13,19)(H2,14,16)(H,17,20)/p+1