3-ethyl-2,6-dimethyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one; hydrogen sulfate

Systemtic Name: 3-ethyl-2,6-dimethyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one; hydrogen sulfate Openeye Name: 3-ethyl-2,6-dimethyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one; hydrogen sulfate CAS Name: 3-ethyl-2,6-dimethyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one; hydrogen sulfate IUPAC Name: 3-ethyl-2,6-dimethyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one; hydrogen sulfate Traditional Name: 3-ethyl-2,6-dimethyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one bisulfate Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC2=CC=CC(=[N+]2C1=O)C)C.OS(=O)(=O)[O-]

Isomeric SMILES

CCC1=C(NC2=CC=CC(=[N+]2C1=O)C)C.OS(=O)(=O)[O-]

InChI

InChI=1S/C12H14N2O.H2O4S/c1-4-10-9(3)13-11-7-5-6-8(2)14(11)12(10)15;1-5(2,3)4/h5-7H,4H2,1-3H3;(H2,1,2,3,4)