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

Systemtic Name: methyl 3-[2-[methylsulfonyl-(4-phenoxyphenyl)amino]propanoylamino]benzoate Openeye Name: methyl 3-[2-(N-methylsulfonyl-4-phenoxy-anilino)propanoylamino]benzoate CAS Name: 3-[[2-(N-methylsulfonyl-4-phenoxyanilino)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[2-(N-methylsulfonyl-4-phenoxyanilino)propanoylamino]benzoate Traditional Name: 3-[2-(N-mesyl-4-phenoxy-anilino)propanoylamino]benzoic acid methyl ester Formula: C24H24N2O6S MolecularWeight: 468.52216

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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)OC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C(=O)OC)N(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C24H24N2O6S/c1-17(23(27)25-19-9-7-8-18(16-19)24(28)31-2)26(33(3,29)30)20-12-14-22(15-13-20)32-21-10-5-4-6-11-21/h4-17H,1-3H3,(H,25,27)