1-[[2-[3-(trifluoromethyl)phenyl]-1-benzothiophen-5-yl]methyl]azetidine-3-carboxylic acid

Systemtic Name: 1-[[2-[3-(trifluoromethyl)phenyl]-1-benzothiophen-5-yl]methyl]azetidine-3-carboxylic acid Openeye Name: 1-[[2-[3-(trifluoromethyl)phenyl]benzothiophen-5-yl]methyl]azetidine-3-carboxylic acid CAS Name: 1-[[2-[3-(trifluoromethyl)phenyl]-1-benzothiophen-5-yl]methyl]-3-azetidinecarboxylic acid IUPAC Name: 1-[[2-[3-(trifluoromethyl)phenyl]-1-benzothiophen-5-yl]methyl]azetidine-3-carboxylic acid Traditional Name: 1-[[2-[3-(trifluoromethyl)phenyl]benzothiophen-5-yl]methyl]azetidine-3-carboxylic acid Formula: C20H16F3NO2S MolecularWeight: 391.40675

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN1CC2=CC3=C(C=C2)SC(=C3)C4=CC(=CC=C4)C(F)(F)F)C(=O)O

Isomeric SMILES

C1C(CN1CC2=CC3=C(C=C2)SC(=C3)C4=CC(=CC=C4)C(F)(F)F)C(=O)O

InChI

InChI=1S/C20H16F3NO2S/c21-20(22,23)16-3-1-2-13(7-16)18-8-14-6-12(4-5-17(14)27-18)9-24-10-15(11-24)19(25)26/h1-8,15H,9-11H2,(H,25,26)