5-[(3-chloranyl-4-fluoranyl-phenyl)amino]-5-oxidanylidene-2-[(4-phenylphenyl)sulfonylamino]pentanoic acid

Systemtic Name: 5-[(3-chloranyl-4-fluoranyl-phenyl)amino]-5-oxidanylidene-2-[(4-phenylphenyl)sulfonylamino]pentanoic acid Openeye Name: 5-(3-chloro-4-fluoro-anilino)-5-oxo-2-[(4-phenylphenyl)sulfonylamino]pentanoic acid CAS Name: 5-(3-chloro-4-fluoroanilino)-5-oxo-2-[(4-phenylphenyl)sulfonylamino]pentanoic acid IUPAC Name: 5-(3-chloro-4-fluoroanilino)-5-oxo-2-[(4-phenylphenyl)sulfonylamino]pentanoic acid Traditional Name: 5-(3-chloro-4-fluoro-anilino)-5-keto-2-[(4-phenylphenyl)sulfonylamino]valeric acid Formula: C23H20ClFN2O5S MolecularWeight: 490.931703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CCC(=O)NC3=CC(=C(C=C3)F)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CCC(=O)NC3=CC(=C(C=C3)F)Cl)C(=O)O

InChI

InChI=1S/C23H20ClFN2O5S/c24-19-14-17(8-11-20(19)25)26-22(28)13-12-21(23(29)30)27-33(31,32)18-9-6-16(7-10-18)15-4-2-1-3-5-15/h1-11,14,21,27H,12-13H2,(H,26,28)(H,29,30)