(3-ethoxy-5-methyl-phenyl) 2-methoxybenzenesulfonate; 2-(methylideneamino)guanidine; ethanoate

Systemtic Name: (3-ethoxy-5-methyl-phenyl) 2-methoxybenzenesulfonate; 2-(methylideneamino)guanidine; ethanoate Openeye Name: (3-ethoxy-5-methyl-phenyl) 2-methoxybenzenesulfonate; 2-(methyleneamino)guanidine; acetate CAS Name: 2-methoxybenzenesulfonic acid (3-ethoxy-5-methylphenyl) ester; 2-(methyleneamino)guanidine; acetate IUPAC Name: (3-ethoxy-5-methylphenyl) 2-methoxybenzenesulfonate; 2-(methylideneamino)guanidine; acetate Traditional Name: 2-methoxybenzenesulfonic acid (3-ethoxy-5-methyl-phenyl) ester; 2-(methyleneamino)guanidine; acetate Formula: C20H27N4O7S- MolecularWeight: 467.51598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)C)OS(=O)(=O)C2=CC=CC=C2OC.CC(=O)[O-].C=NN=C(N)N

Isomeric SMILES

CCOC1=CC(=CC(=C1)C)OS(=O)(=O)C2=CC=CC=C2OC.CC(=O)[O-].C=NN=C(N)N

InChI

InChI=1S/C16H18O5S.C2H6N4.C2H4O2/c1-4-20-13-9-12(2)10-14(11-13)21-22(17,18)16-8-6-5-7-15(16)19-3;1-5-6-2(3)4;1-2(3)4/h5-11H,4H2,1-3H3;1H2,(H4,3,4,6);1H3,(H,3,4)/p-1