methyl 3-[2-[(2,5-dimethoxyphenyl)-methylsulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 3-[2-[(2,5-dimethoxyphenyl)-methylsulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 3-[[2-(2,5-dimethoxy-N-methylsulfonyl-anilino)acetyl]amino]benzoate CAS Name: 3-[[2-(2,5-dimethoxy-N-methylsulfonylanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(2,5-dimethoxy-N-methylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 3-[[2-(N-mesyl-2,5-dimethoxy-anilino)acetyl]amino]benzoic acid methyl ester Formula: C19H22N2O7S MolecularWeight: 422.45218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N(CC(=O)NC2=CC=CC(=C2)C(=O)OC)S(=O)(=O)C

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N(CC(=O)NC2=CC=CC(=C2)C(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C19H22N2O7S/c1-26-15-8-9-17(27-2)16(11-15)21(29(4,24)25)12-18(22)20-14-7-5-6-13(10-14)19(23)28-3/h5-11H,12H2,1-4H3,(H,20,22)