dimethyl-(phenylmethyl)azanium; ethyl 2-methylprop-2-enoate; methyl sulfate

Systemtic Name: dimethyl-(phenylmethyl)azanium; ethyl 2-methylprop-2-enoate; methyl sulfate Openeye Name: benzyl(dimethyl)ammonium; ethyl 2-methylprop-2-enoate; methyl sulfate CAS Name: dimethyl-(phenylmethyl)ammonium; 2-methyl-2-propenoic acid ethyl ester; methyl sulfate IUPAC Name: benzyl(dimethyl)azanium; ethyl 2-methylprop-2-enoate; methyl sulfate Traditional Name: benzyl(dimethyl)ammonium; 2-methylacrylic acid ethyl ester; methyl sulfate Formula: C16H27NO6S MolecularWeight: 361.45368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C)C.C[NH+](C)CC1=CC=CC=C1.COS(=O)(=O)[O-]

Isomeric SMILES

CCOC(=O)C(=C)C.C[NH+](C)CC1=CC=CC=C1.COS(=O)(=O)[O-]

InChI

InChI=1S/C9H13N.C6H10O2.CH4O4S/c1-10(2)8-9-6-4-3-5-7-9;1-4-8-6(7)5(2)3;1-5-6(2,3)4/h3-7H,8H2,1-2H3;2,4H2,1,3H3;1H3,(H,2,3,4)