2-(4-chlorophenyl)sulfonyl-8-thiophen-2-yl-octanoic acid

Systemtic Name: 2-(4-chlorophenyl)sulfonyl-8-thiophen-2-yl-octanoic acid Openeye Name: 2-(4-chlorophenyl)sulfonyl-8-(2-thienyl)octanoic acid CAS Name: 2-(4-chlorophenyl)sulfonyl-8-thiophen-2-yloctanoic acid IUPAC Name: 2-(4-chlorophenyl)sulfonyl-8-thiophen-2-yloctanoic acid Traditional Name: 2-(4-chlorophenyl)sulfonyl-8-(2-thienyl)caprylic acid Formula: C18H21ClO4S2 MolecularWeight: 400.93994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCCCCCC(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CSC(=C1)CCCCCCC(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H21ClO4S2/c19-14-9-11-16(12-10-14)25(22,23)17(18(20)21)8-4-2-1-3-6-15-7-5-13-24-15/h5,7,9-13,17H,1-4,6,8H2,(H,20,21)