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1-[(5-bromanyl-2-ethoxy-phenyl)-[2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid

1-[(5-bromanyl-2-ethoxy-phenyl)-[2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid

Systemtic Name:1-[(5-bromanyl-2-ethoxy-phenyl)-[2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid
Openeye Name:1-[(5-bromo-2-ethoxy-phenyl)-[2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid
CAS Name:1-[(5-bromo-2-ethoxyphenyl)-[2-(trifluoromethyl)phenyl]methyl]-2-pyrrolidinecarboxylic acid
IUPAC Name:1-[(5-bromo-2-ethoxyphenyl)-[2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid
Traditional Name:1-[(5-bromo-2-ethoxy-phenyl)-[2-(trifluoromethyl)phenyl]methyl]proline
Formula: C21H21BrF3NO3
MolecularWeight: 472.29555
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C(C2=CC=CC=C2C(F)(F)F)N3CCCC3C(=O)O


Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C(C2=CC=CC=C2C(F)(F)F)N3CCCC3C(=O)O


InChI

InChI=1S/C21H21BrF3NO3/c1-2-29-18-10-9-13(22)12-15(18)19(26-11-5-8-17(26)20(27)28)14-6-3-4-7-16(14)21(23,24)25/h3-4,6-7,9-10,12,17,19H,2,5,8,11H2,1H3,(H,27,28)


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