1-[(4-azanyl-1,2-dimethyl-pyrimidin-1-ium-5-yl)methyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[(4-azanyl-1,2-dimethyl-pyrimidin-1-ium-5-yl)methyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[(4-amino-1,2-dimethyl-pyrimidin-1-ium-5-yl)methyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[(4-amino-1,2-dimethyl-5-pyrimidin-1-iumyl)methyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[(4-amino-1,2-dimethylpyrimidin-1-ium-5-yl)methyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[(4-amino-1,2-dimethyl-pyrimidin-1-ium-5-yl)methyl]pyridin-1-ium-3-carboxamide Formula: C13H17N5O+2 MolecularWeight: 259.30698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C(=N1)N)C[N+]2=CC=CC(=C2)C(=O)N)C

Isomeric SMILES

CC1=[N+](C=C(C(=N1)N)C[N+]2=CC=CC(=C2)C(=O)N)C

InChI

InChI=1S/C13H15N5O/c1-9-16-12(14)11(6-17(9)2)8-18-5-3-4-10(7-18)13(15)19/h3-7,14H,8H2,1-2H3,(H-,15,19)/p+2