2-[4-[(5-chloranyl-1-benzothiophen-3-yl)methylsulfanyl]-2-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(5-chloranyl-1-benzothiophen-3-yl)methylsulfanyl]-2-methyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[(5-chlorobenzothiophen-3-yl)methylsulfanyl]-2-methyl-phenoxy]acetic acid CAS Name: 2-[4-[(5-chloro-1-benzothiophen-3-yl)methylthio]-2-methylphenoxy]acetic acid IUPAC Name: 2-[4-[(5-chloro-1-benzothiophen-3-yl)methylsulfanyl]-2-methylphenoxy]acetic acid Traditional Name: 2-[4-[(5-chlorobenzothiophen-3-yl)methylthio]-2-methyl-phenoxy]acetic acid Formula: C18H15ClO3S2 MolecularWeight: 378.8929

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SCC2=CSC3=C2C=C(C=C3)Cl)OCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)SCC2=CSC3=C2C=C(C=C3)Cl)OCC(=O)O

InChI

InChI=1S/C18H15ClO3S2/c1-11-6-14(3-4-16(11)22-8-18(20)21)23-9-12-10-24-17-5-2-13(19)7-15(12)17/h2-7,10H,8-9H2,1H3,(H,20,21)