2-[5-chloranyl-1-(4-fluorophenyl)indol-3-yl]sulfanylethanoic acid

Systemtic Name: 2-[5-chloranyl-1-(4-fluorophenyl)indol-3-yl]sulfanylethanoic acid Openeye Name: 2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]sulfanylacetic acid CAS Name: 2-[[5-chloro-1-(4-fluorophenyl)-3-indolyl]thio]acetic acid IUPAC Name: 2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]sulfanylacetic acid Traditional Name: 2-[[5-chloro-1-(4-fluorophenyl)indol-3-yl]thio]acetic acid Formula: C16H11ClFNO2S MolecularWeight: 335.780443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C=C(C3=C2C=CC(=C3)Cl)SCC(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1N2C=C(C3=C2C=CC(=C3)Cl)SCC(=O)O)F

InChI

InChI=1S/C16H11ClFNO2S/c17-10-1-6-14-13(7-10)15(22-9-16(20)21)8-19(14)12-4-2-11(18)3-5-12/h1-8H,9H2,(H,20,21)