2-(4-chlorophenyl)sulfanyl-7-phenyl-heptanoic acid

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-7-phenyl-heptanoic acid Openeye Name: 2-(4-chlorophenyl)sulfanyl-7-phenyl-heptanoic acid CAS Name: 2-[(4-chlorophenyl)thio]-7-phenylheptanoic acid IUPAC Name: 2-(4-chlorophenyl)sulfanyl-7-phenylheptanoic acid Traditional Name: 2-[(4-chlorophenyl)thio]-7-phenyl-enanthic acid Formula: C19H21ClO2S MolecularWeight: 348.88684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCC(C(=O)O)SC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCCCC(C(=O)O)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H21ClO2S/c20-16-11-13-17(14-12-16)23-18(19(21)22)10-6-2-5-9-15-7-3-1-4-8-15/h1,3-4,7-8,11-14,18H,2,5-6,9-10H2,(H,21,22)