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

Systemtic Name: ethyl 4-[2-[methylsulfonyl-(4-phenoxyphenyl)amino]propanoylamino]benzoate Openeye Name: ethyl 4-[2-(N-methylsulfonyl-4-phenoxy-anilino)propanoylamino]benzoate CAS Name: 4-[[2-(N-methylsulfonyl-4-phenoxyanilino)-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(N-methylsulfonyl-4-phenoxyanilino)propanoylamino]benzoate Traditional Name: 4-[2-(N-mesyl-4-phenoxy-anilino)propanoylamino]benzoic acid ethyl ester Formula: C25H26N2O6S MolecularWeight: 482.54874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)N(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)N(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C25H26N2O6S/c1-4-32-25(29)19-10-12-20(13-11-19)26-24(28)18(2)27(34(3,30)31)21-14-16-23(17-15-21)33-22-8-6-5-7-9-22/h5-18H,4H2,1-3H3,(H,26,28)