8-[[4-(4-chlorophenyl)carbonylphenyl]sulfonylamino]octanoic acid

Systemtic Name: 8-[[4-(4-chlorophenyl)carbonylphenyl]sulfonylamino]octanoic acid Openeye Name: 8-[[4-(4-chlorobenzoyl)phenyl]sulfonylamino]octanoic acid CAS Name: 8-[[4-[(4-chlorophenyl)-oxomethyl]phenyl]sulfonylamino]octanoic acid IUPAC Name: 8-[[4-(4-chlorobenzoyl)phenyl]sulfonylamino]octanoic acid Traditional Name: 8-[[4-(4-chlorobenzoyl)phenyl]sulfonylamino]caprylic acid Formula: C21H24ClNO5S MolecularWeight: 437.93696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClNO5S/c22-18-11-7-16(8-12-18)21(26)17-9-13-19(14-10-17)29(27,28)23-15-5-3-1-2-4-6-20(24)25/h7-14,23H,1-6,15H2,(H,24,25)