(4-azanyl-1,2-dimethyl-pyrimidin-1-ium-5-yl)methyl ethanoate

Systemtic Name: (4-azanyl-1,2-dimethyl-pyrimidin-1-ium-5-yl)methyl ethanoate Openeye Name: (4-amino-1,2-dimethyl-pyrimidin-1-ium-5-yl)methyl acetate CAS Name: acetic acid (4-amino-1,2-dimethyl-5-pyrimidin-1-iumyl)methyl ester IUPAC Name: (4-amino-1,2-dimethylpyrimidin-1-ium-5-yl)methyl acetate Traditional Name: acetic acid (4-amino-1,2-dimethyl-pyrimidin-1-ium-5-yl)methyl ester Formula: C9H14N3O2+ MolecularWeight: 196.22636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C(=N1)N)COC(=O)C)C

Isomeric SMILES

CC1=[N+](C=C(C(=N1)N)COC(=O)C)C

InChI

InChI=1S/C9H13N3O2/c1-6-11-9(10)8(4-12(6)3)5-14-7(2)13/h4,10H,5H2,1-3H3/p+1