methanediimine; 1-(4-methylmorpholin-4-ium-4-yl)ethyl 4-methylbenzenesulfonate

Systemtic Name: methanediimine; 1-(4-methylmorpholin-4-ium-4-yl)ethyl 4-methylbenzenesulfonate Openeye Name: methanediimine; 1-(4-methylmorpholin-4-ium-4-yl)ethyl 4-methylbenzenesulfonate CAS Name: methanediimine; 4-methylbenzenesulfonic acid 1-(4-methyl-4-morpholin-4-iumyl)ethyl ester IUPAC Name: methanediimine; 1-(4-methylmorpholin-4-ium-4-yl)ethyl 4-methylbenzenesulfonate Traditional Name: iminomethyleneamine; 4-methylbenzenesulfonic acid 1-(4-methylmorpholin-4-ium-4-yl)ethyl ester Formula: C15H24N3O4S+ MolecularWeight: 342.43376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C)[N+]2(CCOCC2)C.C(=N)=N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C)[N+]2(CCOCC2)C.C(=N)=N

InChI

InChI=1S/C14H22NO4S.CH2N2/c1-12-4-6-14(7-5-12)20(16,17)19-13(2)15(3)8-10-18-11-9-15;2-1-3/h4-7,13H,8-11H2,1-3H3;2-3H/q+1;