cyanomethyl 2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoate

Systemtic Name: cyanomethyl 2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoate Openeye Name: cyanomethyl 2-(2-methyl-N-methylsulfonyl-anilino)acetate CAS Name: 2-(2-methyl-N-methylsulfonylanilino)acetic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-(2-methyl-N-methylsulfonylanilino)acetate Traditional Name: 2-(N-mesyl-2-methyl-anilino)acetic acid cyanomethyl ester Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)OCC#N)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)OCC#N)S(=O)(=O)C

InChI

InChI=1S/C12H14N2O4S/c1-10-5-3-4-6-11(10)14(19(2,16)17)9-12(15)18-8-7-13/h3-6H,8-9H2,1-2H3