ethyl 3-[[4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]phenyl]carbonylamino]benzoate Openeye Name: ethyl 3-[[4-[(3-chloro-N-methylsulfonyl-anilino)methyl]benzoyl]amino]benzoate CAS Name: 3-[[[4-[(3-chloro-N-methylsulfonylanilino)methyl]phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-[(3-chloro-N-methylsulfonylanilino)methyl]benzoyl]amino]benzoate Traditional Name: 3-[[4-[(3-chloro-N-mesyl-anilino)methyl]benzoyl]amino]benzoic acid ethyl ester Formula: C24H23ClN2O5S MolecularWeight: 486.96782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23ClN2O5S/c1-3-32-24(29)19-6-4-8-21(14-19)26-23(28)18-12-10-17(11-13-18)16-27(33(2,30)31)22-9-5-7-20(25)15-22/h4-15H,3,16H2,1-2H3,(H,26,28)