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1-[3-bromanyl-4-oxidanylidene-4-[3-(trifluoromethyl)phenyl]butanoyl]pyrrolidine-2-carboxylic acid

1-[3-bromanyl-4-oxidanylidene-4-[3-(trifluoromethyl)phenyl]butanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name:1-[3-bromanyl-4-oxidanylidene-4-[3-(trifluoromethyl)phenyl]butanoyl]pyrrolidine-2-carboxylic acid
Openeye Name:1-[3-bromo-4-oxo-4-[3-(trifluoromethyl)phenyl]butanoyl]pyrrolidine-2-carboxylic acid
CAS Name:1-[3-bromo-1,4-dioxo-4-[3-(trifluoromethyl)phenyl]butyl]-2-pyrrolidinecarboxylic acid
IUPAC Name:1-[3-bromo-4-oxo-4-[3-(trifluoromethyl)phenyl]butanoyl]pyrrolidine-2-carboxylic acid
Traditional Name:1-[3-bromo-4-keto-4-[3-(trifluoromethyl)phenyl]butanoyl]proline
Formula: C16H15BrF3NO4
MolecularWeight: 422.19381
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC(C(=O)C2=CC(=CC=C2)C(F)(F)F)Br)C(=O)O


Isomeric SMILES

C1CC(N(C1)C(=O)CC(C(=O)C2=CC(=CC=C2)C(F)(F)F)Br)C(=O)O


InChI

InChI=1S/C16H15BrF3NO4/c17-11(8-13(22)21-6-2-5-12(21)15(24)25)14(23)9-3-1-4-10(7-9)16(18,19)20/h1,3-4,7,11-12H,2,5-6,8H2,(H,24,25)


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