1-[(5-bromanyl-2-methoxy-phenyl)-(4-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-bromanyl-2-methoxy-phenyl)-(4-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-bromo-2-methoxy-phenyl)-(4-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-bromo-2-methoxyphenyl)-(4-fluorophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-bromo-2-methoxyphenyl)-(4-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-bromo-2-methoxy-phenyl)-(4-fluorophenyl)methyl]proline Formula: C19H19BrFNO3 MolecularWeight: 408.261463

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(C2=CC=C(C=C2)F)N3CCCC3C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(C2=CC=C(C=C2)F)N3CCCC3C(=O)O

InChI

InChI=1S/C19H19BrFNO3/c1-25-17-9-6-13(20)11-15(17)18(12-4-7-14(21)8-5-12)22-10-2-3-16(22)19(23)24/h4-9,11,16,18H,2-3,10H2,1H3,(H,23,24)