1-[azanyl-[(4,6-dimethylpyrimidin-2-yl)amino]methylidene]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[azanyl-[(4,6-dimethylpyrimidin-2-yl)amino]methylidene]piperidin-1-ium-4-carboxamide Openeye Name: 1-[amino-[(4,6-dimethylpyrimidin-2-yl)amino]methylene]piperidin-1-ium-4-carboxamide CAS Name: 1-[amino-[(4,6-dimethyl-2-pyrimidinyl)amino]methylidene]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[amino-[(4,6-dimethylpyrimidin-2-yl)amino]methylidene]piperidin-1-ium-4-carboxamide Traditional Name: 1-[amino-[(4,6-dimethylpyrimidin-2-yl)amino]methylene]piperidin-1-ium-4-carboxamide Formula: C13H21N6O+ MolecularWeight: 277.34544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=[N+]2CCC(CC2)C(=O)N)N)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=[N+]2CCC(CC2)C(=O)N)N)C

InChI

InChI=1S/C13H20N6O/c1-8-7-9(2)17-13(16-8)18-12(15)19-5-3-10(4-6-19)11(14)20/h7,10H,3-6H2,1-2H3,(H4,14,15,16,17,18,20)/p+1