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

Systemtic Name: butyl 4-[2-[methylsulfonyl-(2-phenoxyphenyl)amino]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-(N-methylsulfonyl-2-phenoxy-anilino)acetyl]amino]benzoate CAS Name: 4-[[2-(N-methylsulfonyl-2-phenoxyanilino)-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(N-methylsulfonyl-2-phenoxyanilino)acetyl]amino]benzoate Traditional Name: 4-[[2-(N-mesyl-2-phenoxy-anilino)acetyl]amino]benzoic acid butyl ester Formula: C26H28N2O6S MolecularWeight: 496.57532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N2O6S/c1-3-4-18-33-26(30)20-14-16-21(17-15-20)27-25(29)19-28(35(2,31)32)23-12-8-9-13-24(23)34-22-10-6-5-7-11-22/h5-17H,3-4,18-19H2,1-2H3,(H,27,29)