1-(4-methylpiperazin-1-yl)prop-2-en-1-one; methyl sulfate

Systemtic Name: 1-(4-methylpiperazin-1-yl)prop-2-en-1-one; methyl sulfate Openeye Name: 1-(4-methylpiperazin-1-yl)prop-2-en-1-one; methyl sulfate CAS Name: 1-(4-methyl-1-piperazinyl)-2-propen-1-one; methyl sulfate IUPAC Name: 1-(4-methylpiperazin-1-yl)prop-2-en-1-one; methyl sulfate Traditional Name: 1-(4-methylpiperazino)prop-2-en-1-one; methyl sulfate Formula: C9H17N2O5S- MolecularWeight: 265.30668

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C=C.COS(=O)(=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C(=O)C=C.COS(=O)(=O)[O-]

InChI

InChI=1S/C8H14N2O.CH4O4S/c1-3-8(11)10-6-4-9(2)5-7-10;1-5-6(2,3)4/h3H,1,4-7H2,2H3;1H3,(H,2,3,4)/p-1