1-methyl-4-oxidanylidene-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-1-ium-3-carboxamide; methyl sulfate

Systemtic Name: 1-methyl-4-oxidanylidene-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-1-ium-3-carboxamide; methyl sulfate Openeye Name: 1-methyl-4-oxo-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-1-ium-3-carboxamide; methyl sulfate CAS Name: 1-methyl-4-oxo-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-1-ium-3-carboxamide; methyl sulfate IUPAC Name: 1-methyl-4-oxo-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-1-ium-3-carboxamide; methyl sulfate Traditional Name: 4-keto-1-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-1-ium-3-carboxamide; methyl sulfate Formula: C10H15N3O6S MolecularWeight: 305.3076

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2CCCN2C(=O)C(=C1)C(=O)N.COS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=C2CCCN2C(=O)C(=C1)C(=O)N.COS(=O)(=O)[O-]

InChI

InChI=1S/C9H11N3O2.CH4O4S/c1-11-5-6(8(10)13)9(14)12-4-2-3-7(11)12;1-5-6(2,3)4/h5H,2-4H2,1H3,(H-,10,13);1H3,(H,2,3,4)