cyanomethyl 4-methyl-3-[(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: cyanomethyl 4-methyl-3-[(phenylmethyl)sulfamoyl]benzoate Openeye Name: cyanomethyl 3-(benzylsulfamoyl)-4-methyl-benzoate CAS Name: 4-methyl-3-[(phenylmethyl)sulfamoyl]benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-(benzylsulfamoyl)-4-methylbenzoate Traditional Name: 3-(benzylsulfamoyl)-4-methyl-benzoic acid cyanomethyl ester Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC#N)S(=O)(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC#N)S(=O)(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C17H16N2O4S/c1-13-7-8-15(17(20)23-10-9-18)11-16(13)24(21,22)19-12-14-5-3-2-4-6-14/h2-8,11,19H,10,12H2,1H3