ethyl 4-[2-[(2,5-dimethoxyphenyl)-methylsulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[(2,5-dimethoxyphenyl)-methylsulfonyl-amino]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(2,5-dimethoxy-N-methylsulfonyl-anilino)acetyl]amino]benzoate CAS Name: 4-[[2-(2,5-dimethoxy-N-methylsulfonylanilino)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(2,5-dimethoxy-N-methylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 4-[[2-(N-mesyl-2,5-dimethoxy-anilino)acetyl]amino]benzoic acid ethyl ester Formula: C20H24N2O7S MolecularWeight: 436.47876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(C2=C(C=CC(=C2)OC)OC)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(C2=C(C=CC(=C2)OC)OC)S(=O)(=O)C

InChI

InChI=1S/C20H24N2O7S/c1-5-29-20(24)14-6-8-15(9-7-14)21-19(23)13-22(30(4,25)26)17-12-16(27-2)10-11-18(17)28-3/h6-12H,5,13H2,1-4H3,(H,21,23)