methyl 4-[2-[methylsulfonyl-(2-phenoxyphenyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[methylsulfonyl-(2-phenoxyphenyl)amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(N-methylsulfonyl-2-phenoxy-anilino)acetyl]amino]benzoate CAS Name: 4-[[2-(N-methylsulfonyl-2-phenoxyanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(N-methylsulfonyl-2-phenoxyanilino)acetyl]amino]benzoate Traditional Name: 4-[[2-(N-mesyl-2-phenoxy-anilino)acetyl]amino]benzoic acid methyl ester Formula: C23H22N2O6S MolecularWeight: 454.49558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N2O6S/c1-30-23(27)17-12-14-18(15-13-17)24-22(26)16-25(32(2,28)29)20-10-6-7-11-21(20)31-19-8-4-3-5-9-19/h3-15H,16H2,1-2H3,(H,24,26)