4-ethanoylsulfanyl-2-[[2,4,5-tris(fluoranyl)phenyl]methoxymethyl]pyrrolidine-1-carboxylic acid

Systemtic Name: 4-ethanoylsulfanyl-2-[[2,4,5-tris(fluoranyl)phenyl]methoxymethyl]pyrrolidine-1-carboxylic acid Openeye Name: 4-acetylsulfanyl-2-[(2,4,5-trifluorophenyl)methoxymethyl]pyrrolidine-1-carboxylic acid CAS Name: 4-(acetylthio)-2-[(2,4,5-trifluorophenyl)methoxymethyl]-1-pyrrolidinecarboxylic acid IUPAC Name: 4-acetylsulfanyl-2-[(2,4,5-trifluorophenyl)methoxymethyl]pyrrolidine-1-carboxylic acid Traditional Name: 4-(acetylthio)-2-[(2,4,5-trifluorobenzyl)oxymethyl]pyrrolidine-1-carboxylic acid Formula: C15H16F3NO4S MolecularWeight: 363.35205

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CC(N(C1)C(=O)O)COCC2=CC(=C(C=C2F)F)F

Isomeric SMILES

CC(=O)SC1CC(N(C1)C(=O)O)COCC2=CC(=C(C=C2F)F)F

InChI

InChI=1S/C15H16F3NO4S/c1-8(20)24-11-3-10(19(5-11)15(21)22)7-23-6-9-2-13(17)14(18)4-12(9)16/h2,4,10-11H,3,5-7H2,1H3,(H,21,22)