1-tert-butyl-5-methoxy-2,3-dihydro-1H-pyrrol-1-ium; methyl sulfate

Systemtic Name: 1-tert-butyl-5-methoxy-2,3-dihydro-1H-pyrrol-1-ium; methyl sulfate Openeye Name: 1-tert-butyl-5-methoxy-2,3-dihydro-1H-pyrrol-1-ium; methyl sulfate CAS Name: 1-tert-butyl-5-methoxy-2,3-dihydro-1H-pyrrol-1-ium; methyl sulfate IUPAC Name: 1-tert-butyl-5-methoxy-2,3-dihydro-1H-pyrrol-1-ium; methyl sulfate Traditional Name: 1-tert-butyl-2-methoxy-2-pyrrolin-1-ium; methyl sulfate Formula: C10H21NO5S MolecularWeight: 267.34244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH+]1CCC=C1OC.COS(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)[NH+]1CCC=C1OC.COS(=O)(=O)[O-]

InChI

InChI=1S/C9H17NO.CH4O4S/c1-9(2,3)10-7-5-6-8(10)11-4;1-5-6(2,3)4/h6H,5,7H2,1-4H3;1H3,(H,2,3,4)