6-methylsulfinyl-5-[4-(trifluoromethyl)phenyl]carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid

Systemtic Name: 6-methylsulfinyl-5-[4-(trifluoromethyl)phenyl]carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Openeye Name: 6-methylsulfinyl-5-[4-(trifluoromethyl)benzoyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid CAS Name: 6-methylsulfinyl-5-[oxo-[4-(trifluoromethyl)phenyl]methyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid IUPAC Name: 6-methylsulfinyl-5-[4-(trifluoromethyl)benzoyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Traditional Name: 6-methylsulfinyl-5-[4-(trifluoromethyl)benzoyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Formula: C17H14F3NO4S MolecularWeight: 385.35757

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=C(N2CCC(C2=C1)C(=O)O)C(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CS(=O)C1=C(N2CCC(C2=C1)C(=O)O)C(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H14F3NO4S/c1-26(25)13-8-12-11(16(23)24)6-7-21(12)14(13)15(22)9-2-4-10(5-3-9)17(18,19)20/h2-5,8,11H,6-7H2,1H3,(H,23,24)