methyl 3-[2-[(4-methoxyphenyl)-methylsulfonyl-amino]propanoylamino]benzoate

Systemtic Name: methyl 3-[2-[(4-methoxyphenyl)-methylsulfonyl-amino]propanoylamino]benzoate Openeye Name: methyl 3-[2-(4-methoxy-N-methylsulfonyl-anilino)propanoylamino]benzoate CAS Name: 3-[[2-(4-methoxy-N-methylsulfonylanilino)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[2-(4-methoxy-N-methylsulfonylanilino)propanoylamino]benzoate Traditional Name: 3-[2-(N-mesyl-4-methoxy-anilino)propanoylamino]benzoic acid methyl ester Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(=O)OC)N(C2=CC=C(C=C2)OC)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C(=O)OC)N(C2=CC=C(C=C2)OC)S(=O)(=O)C

InChI

InChI=1S/C19H22N2O6S/c1-13(18(22)20-15-7-5-6-14(12-15)19(23)27-3)21(28(4,24)25)16-8-10-17(26-2)11-9-16/h5-13H,1-4H3,(H,20,22)