ethyl 2-[benzamidomethyl-(4-methylphenyl)sulfonyl-amino]ethanoate

Systemtic Name: ethyl 2-[benzamidomethyl-(4-methylphenyl)sulfonyl-amino]ethanoate Openeye Name: ethyl 2-[benzamidomethyl(p-tolylsulfonyl)amino]acetate CAS Name: 2-[benzamidomethyl-(4-methylphenyl)sulfonylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[benzamidomethyl-(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-[benzamidomethyl(tosyl)amino]acetic acid ethyl ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CNC(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)CN(CNC(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H22N2O5S/c1-3-26-18(22)13-21(14-20-19(23)16-7-5-4-6-8-16)27(24,25)17-11-9-15(2)10-12-17/h4-12H,3,13-14H2,1-2H3,(H,20,23)