methyl sulfate; 4-propoxy-1H-pyrazol-1-ium

Systemtic Name: methyl sulfate; 4-propoxy-1H-pyrazol-1-ium Openeye Name: methyl sulfate; 4-propoxy-1H-pyrazol-1-ium CAS Name: methyl sulfate; 4-propoxy-1H-pyrazol-1-ium IUPAC Name: methyl sulfate; 4-propoxy-1H-pyrazol-1-ium Traditional Name: methyl sulfate; 4-propoxy-1H-pyrazol-1-ium Formula: C7H14N2O5S MolecularWeight: 238.26146

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C[NH2+]N=C1.COS(=O)(=O)[O-]

Isomeric SMILES

CCCOC1=C[NH2+]N=C1.COS(=O)(=O)[O-]

InChI

InChI=1S/C6H10N2O.CH4O4S/c1-2-3-9-6-4-7-8-5-6;1-5-6(2,3)4/h4-5H,2-3H2,1H3,(H,7,8);1H3,(H,2,3,4)