dimethyl-bis(prop-2-enyl)azanium; prop-2-enamide; 2-sulfanylethanol; chloride

Systemtic Name: dimethyl-bis(prop-2-enyl)azanium; prop-2-enamide; 2-sulfanylethanol; chloride Openeye Name: diallyl(dimethyl)ammonium; prop-2-enamide; 2-sulfanylethanol; chloride CAS Name: dimethyl-bis(prop-2-enyl)ammonium; 2-mercaptoethanol; 2-propenamide; chloride IUPAC Name: dimethyl-bis(prop-2-enyl)azanium; prop-2-enamide; 2-sulfanylethanol; chloride Traditional Name: acrylamide; diallyl(dimethyl)ammonium; 2-mercaptoethanol; chloride Formula: C13H27ClN2O2S MolecularWeight: 310.88368

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC=C)CC=C.C=CC(=O)N.C(CS)O.[Cl-]

Isomeric SMILES

C[N+](C)(CC=C)CC=C.C=CC(=O)N.C(CS)O.[Cl-]

InChI

InChI=1S/C8H16N.C3H5NO.C2H6OS.ClH/c1-5-7-9(3,4)8-6-2;1-2-3(4)5;3-1-2-4;/h5-6H,1-2,7-8H2,3-4H3;2H,1H2,(H2,4,5);3-4H,1-2H2;1H/q+1;;;/p-1