ethyl 3-[2-[methylsulfonyl-(4-phenylmethoxyphenyl)amino]ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-[methylsulfonyl-(4-phenylmethoxyphenyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-(4-benzyloxy-N-methylsulfonyl-anilino)acetyl]amino]benzoate CAS Name: 3-[[2-(N-methylsulfonyl-4-phenylmethoxyanilino)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(N-methylsulfonyl-4-phenylmethoxyanilino)acetyl]amino]benzoate Traditional Name: 3-[[2-(4-benzoxy-N-mesyl-anilino)acetyl]amino]benzoic acid ethyl ester Formula: C25H26N2O6S MolecularWeight: 482.54874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CN(C2=CC=C(C=C2)OCC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CN(C2=CC=C(C=C2)OCC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C25H26N2O6S/c1-3-32-25(29)20-10-7-11-21(16-20)26-24(28)17-27(34(2,30)31)22-12-14-23(15-13-22)33-18-19-8-5-4-6-9-19/h4-16H,3,17-18H2,1-2H3,(H,26,28)