2-(2-methylprop-2-enoylamino)ethyl-pentan-3-yl-azanium; methyl sulfate

Systemtic Name: 2-(2-methylprop-2-enoylamino)ethyl-pentan-3-yl-azanium; methyl sulfate Openeye Name: 1-ethylpropyl-[2-(2-methylprop-2-enoylamino)ethyl]ammonium; methyl sulfate CAS Name: 2-[(2-methyl-1-oxoprop-2-enyl)amino]ethyl-pentan-3-ylammonium; methyl sulfate IUPAC Name: 2-(2-methylprop-2-enoylamino)ethyl-pentan-3-ylazanium; methyl sulfate Traditional Name: 1-ethylpropyl(2-methacrylamidoethyl)ammonium; methyl sulfate Formula: C12H26N2O5S MolecularWeight: 310.41024

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CCNC(=O)C(=C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CCC(CC)[NH2+]CCNC(=O)C(=C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C11H22N2O.CH4O4S/c1-5-10(6-2)12-7-8-13-11(14)9(3)4;1-5-6(2,3)4/h10,12H,3,5-8H2,1-2,4H3,(H,13,14);1H3,(H,2,3,4)