2-[methyl(nitroso)amino]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[methyl(nitroso)amino]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[methyl(nitroso)amino]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[methyl(nitroso)amino]ethyl ester IUPAC Name: 2-[methyl(nitroso)amino]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[methyl(nitroso)amino]ethyl ester Formula: C10H14N2O4S MolecularWeight: 258.29416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCN(C)N=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCN(C)N=O

InChI

InChI=1S/C10H14N2O4S/c1-9-3-5-10(6-4-9)17(14,15)16-8-7-12(2)11-13/h3-6H,7-8H2,1-2H3