ethyl 3-[2-[methylsulfonyl(phenyl)amino]propanoylamino]benzoate

Systemtic Name: ethyl 3-[2-[methylsulfonyl(phenyl)amino]propanoylamino]benzoate Openeye Name: ethyl 3-[2-(N-methylsulfonylanilino)propanoylamino]benzoate CAS Name: 3-[[2-(N-methylsulfonylanilino)-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[2-(N-methylsulfonylanilino)propanoylamino]benzoate Traditional Name: 3-[2-(N-mesylanilino)propanoylamino]benzoic acid ethyl ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C(C)N(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C(C)N(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C19H22N2O5S/c1-4-26-19(23)15-9-8-10-16(13-15)20-18(22)14(2)21(27(3,24)25)17-11-6-5-7-12-17/h5-14H,4H2,1-3H3,(H,20,22)