butyl 4-[[2-chloranyl-5-[(4-methylphenyl)sulfonylamino]phenyl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[2-chloranyl-5-[(4-methylphenyl)sulfonylamino]phenyl]carbonylamino]benzoate Openeye Name: butyl 4-[[2-chloro-5-(p-tolylsulfonylamino)benzoyl]amino]benzoate CAS Name: 4-[[[2-chloro-5-[(4-methylphenyl)sulfonylamino]phenyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-chloro-5-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate Traditional Name: 4-[[2-chloro-5-(tosylamino)benzoyl]amino]benzoic acid butyl ester Formula: C25H25ClN2O5S MolecularWeight: 500.9944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C)Cl

InChI

InChI=1S/C25H25ClN2O5S/c1-3-4-15-33-25(30)18-7-9-19(10-8-18)27-24(29)22-16-20(11-14-23(22)26)28-34(31,32)21-12-5-17(2)6-13-21/h5-14,16,28H,3-4,15H2,1-2H3,(H,27,29)