4-[[2-[(4-butylphenyl)sulfonylamino]-5-chloranyl-phenyl]carbonylamino]benzoic acid

Systemtic Name: 4-[[2-[(4-butylphenyl)sulfonylamino]-5-chloranyl-phenyl]carbonylamino]benzoic acid Openeye Name: 4-[[2-[(4-butylphenyl)sulfonylamino]-5-chloro-benzoyl]amino]benzoic acid CAS Name: 4-[[[2-[(4-butylphenyl)sulfonylamino]-5-chlorophenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[2-[(4-butylphenyl)sulfonylamino]-5-chlorobenzoyl]amino]benzoic acid Traditional Name: 4-[[2-[(4-butylphenyl)sulfonylamino]-5-chloro-benzoyl]amino]benzoic acid Formula: C24H23ClN2O5S MolecularWeight: 486.96782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C24H23ClN2O5S/c1-2-3-4-16-5-12-20(13-6-16)33(31,32)27-22-14-9-18(25)15-21(22)23(28)26-19-10-7-17(8-11-19)24(29)30/h5-15,27H,2-4H2,1H3,(H,26,28)(H,29,30)