hydrogen sulfate; 3-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-3-ium-2-one

Systemtic Name: hydrogen sulfate; 3-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-3-ium-2-one Openeye Name: hydrogen sulfate; 3-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-3-ium-2-one CAS Name: hydrogen sulfate; 3-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-3-ium-2-one IUPAC Name: hydrogen sulfate; 3-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-3-ium-2-one Traditional Name: 3-(2-hydroxyethyl)-4-methyl-1H-pyrimidin-3-ium-2-one bisulfate Formula: C7H12N2O6S MolecularWeight: 252.24498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=O)NC=C1)CCO.OS(=O)(=O)[O-]

Isomeric SMILES

CC1=[N+](C(=O)NC=C1)CCO.OS(=O)(=O)[O-]

InChI

InChI=1S/C7H10N2O2.H2O4S/c1-6-2-3-8-7(11)9(6)4-5-10;1-5(2,3)4/h2-3,10H,4-5H2,1H3;(H2,1,2,3,4)