methyl 2-chloranyl-5-[2-[methylsulfonyl-(4-phenylmethoxyphenyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 2-chloranyl-5-[2-[methylsulfonyl-(4-phenylmethoxyphenyl)amino]ethanoylamino]benzoate Openeye Name: methyl 5-[[2-(4-benzyloxy-N-methylsulfonyl-anilino)acetyl]amino]-2-chloro-benzoate CAS Name: 2-chloro-5-[[2-(N-methylsulfonyl-4-phenylmethoxyanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[[2-(N-methylsulfonyl-4-phenylmethoxyanilino)acetyl]amino]benzoate Traditional Name: 5-[[2-(4-benzoxy-N-mesyl-anilino)acetyl]amino]-2-chloro-benzoic acid methyl ester Formula: C24H23ClN2O6S MolecularWeight: 502.96722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23ClN2O6S/c1-32-24(29)21-14-18(8-13-22(21)25)26-23(28)15-27(34(2,30)31)19-9-11-20(12-10-19)33-16-17-6-4-3-5-7-17/h3-14H,15-16H2,1-2H3,(H,26,28)