8-[[4-chloranyl-2-(4-chlorophenyl)carbonyl-phenyl]sulfonylamino]octanoic acid

Systemtic Name: 8-[[4-chloranyl-2-(4-chlorophenyl)carbonyl-phenyl]sulfonylamino]octanoic acid Openeye Name: 8-[[4-chloro-2-(4-chlorobenzoyl)phenyl]sulfonylamino]octanoic acid CAS Name: 8-[[4-chloro-2-[(4-chlorophenyl)-oxomethyl]phenyl]sulfonylamino]octanoic acid IUPAC Name: 8-[[4-chloro-2-(4-chlorobenzoyl)phenyl]sulfonylamino]octanoic acid Traditional Name: 8-[[4-chloro-2-(4-chlorobenzoyl)phenyl]sulfonylamino]caprylic acid Formula: C21H23Cl2NO5S MolecularWeight: 472.38202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=C(C=CC(=C2)Cl)S(=O)(=O)NCCCCCCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=C(C=CC(=C2)Cl)S(=O)(=O)NCCCCCCCC(=O)O)Cl

InChI

InChI=1S/C21H23Cl2NO5S/c22-16-9-7-15(8-10-16)21(27)18-14-17(23)11-12-19(18)30(28,29)24-13-5-3-1-2-4-6-20(25)26/h7-12,14,24H,1-6,13H2,(H,25,26)