(4,6-dimethyl-1-oxidanidyl-pyrimidin-1-ium-2-yl)methyl ethanoate

Systemtic Name: (4,6-dimethyl-1-oxidanidyl-pyrimidin-1-ium-2-yl)methyl ethanoate Openeye Name: (4,6-dimethyl-1-oxido-pyrimidin-1-ium-2-yl)methyl acetate CAS Name: acetic acid (4,6-dimethyl-1-oxido-2-pyrimidin-1-iumyl)methyl ester IUPAC Name: (4,6-dimethyl-1-oxidopyrimidin-1-ium-2-yl)methyl acetate Traditional Name: acetic acid (4,6-dimethyl-1-oxido-pyrimidin-1-ium-2-yl)methyl ester Formula: C9H12N2O3 MolecularWeight: 196.20318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12N2O3/c1-6-4-7(2)11(13)9(10-6)5-14-8(3)12/h4H,5H2,1-3H3