7-(4-chlorophenyl)-2-(phenylsulfonyl)heptanoic acid

Systemtic Name: 7-(4-chlorophenyl)-2-(phenylsulfonyl)heptanoic acid Openeye Name: 2-(benzenesulfonyl)-7-(4-chlorophenyl)heptanoic acid CAS Name: 2-(benzenesulfonyl)-7-(4-chlorophenyl)heptanoic acid IUPAC Name: 2-(benzenesulfonyl)-7-(4-chlorophenyl)heptanoic acid Traditional Name: 2-besyl-7-(4-chlorophenyl)enanthic acid Formula: C19H21ClO4S MolecularWeight: 380.88564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C(CCCCCC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C(CCCCCC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C19H21ClO4S/c20-16-13-11-15(12-14-16)7-3-1-6-10-18(19(21)22)25(23,24)17-8-4-2-5-9-17/h2,4-5,8-9,11-14,18H,1,3,6-7,10H2,(H,21,22)