2-(3,5-ditert-butyl-4-oxidanyl-phenyl)guanidine; (3-methylidene-4-oxidanylidene-1,3-oxazolidin-3-ium-2-yl) methanesulfonate

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)guanidine; (3-methylidene-4-oxidanylidene-1,3-oxazolidin-3-ium-2-yl) methanesulfonate Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)guanidine; (3-methylene-4-oxo-oxazolidin-3-ium-2-yl) methanesulfonate CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)guanidine; methanesulfonic acid (3-methylene-4-oxo-2-oxazolidin-3-iumyl) ester IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)guanidine; (3-methylidene-4-oxo-1,3-oxazolidin-3-ium-2-yl) methanesulfonate Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)guanidine; methanesulfonic acid (4-keto-3-methylene-oxazolidin-3-ium-2-yl) ester Formula: C20H33N4O6S+ MolecularWeight: 457.56422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)N=C(N)N.CS(=O)(=O)OC1[N+](=C)C(=O)CO1

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)N=C(N)N.CS(=O)(=O)OC1[N+](=C)C(=O)CO1

InChI

InChI=1S/C15H25N3O.C5H8NO5S/c1-14(2,3)10-7-9(18-13(16)17)8-11(12(10)19)15(4,5)6;1-6-4(7)3-10-5(6)11-12(2,8)9/h7-8,19H,1-6H3,(H4,16,17,18);5H,1,3H2,2H3/q;+1