dimethyl 5-[2-[methylsulfonyl-(2-phenoxyphenyl)amino]ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-[methylsulfonyl-(2-phenoxyphenyl)amino]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(N-methylsulfonyl-2-phenoxy-anilino)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(N-methylsulfonyl-2-phenoxyanilino)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(N-methylsulfonyl-2-phenoxyanilino)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(N-mesyl-2-phenoxy-anilino)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C25H24N2O8S MolecularWeight: 512.53166

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CN(C2=CC=CC=C2OC3=CC=CC=C3)S(=O)(=O)C)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CN(C2=CC=CC=C2OC3=CC=CC=C3)S(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C25H24N2O8S/c1-33-24(29)17-13-18(25(30)34-2)15-19(14-17)26-23(28)16-27(36(3,31)32)21-11-7-8-12-22(21)35-20-9-5-4-6-10-20/h4-15H,16H2,1-3H3,(H,26,28)