methyl 3-ethyl-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoate

Systemtic Name: methyl 3-ethyl-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoate Openeye Name: methyl 3-ethyl-4-[methyl(p-tolylsulfonyl)amino]benzoate CAS Name: 3-ethyl-4-[methyl-(4-methylphenyl)sulfonylamino]benzoic acid methyl ester IUPAC Name: methyl 3-ethyl-4-[methyl-(4-methylphenyl)sulfonylamino]benzoate Traditional Name: 3-ethyl-4-[methyl(tosyl)amino]benzoic acid methyl ester Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C(=O)OC)N(C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCC1=C(C=CC(=C1)C(=O)OC)N(C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H21NO4S/c1-5-14-12-15(18(20)23-4)8-11-17(14)19(3)24(21,22)16-9-6-13(2)7-10-16/h6-12H,5H2,1-4H3