1-[1-(5-bromanyl-2-methoxy-phenyl)-2-pyridin-2-yl-ethyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[1-(5-bromanyl-2-methoxy-phenyl)-2-pyridin-2-yl-ethyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[1-(5-bromo-2-methoxy-phenyl)-2-(2-pyridyl)ethyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[1-(5-bromo-2-methoxyphenyl)-2-(2-pyridinyl)ethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[1-(5-bromo-2-methoxyphenyl)-2-pyridin-2-ylethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[1-(5-bromo-2-methoxy-phenyl)-2-(2-pyridyl)ethyl]proline Formula: C19H21BrN2O3 MolecularWeight: 405.28564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(CC2=CC=CC=N2)N3CCCC3C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(CC2=CC=CC=N2)N3CCCC3C(=O)O

InChI

InChI=1S/C19H21BrN2O3/c1-25-18-8-7-13(20)11-15(18)17(12-14-5-2-3-9-21-14)22-10-4-6-16(22)19(23)24/h2-3,5,7-9,11,16-17H,4,6,10,12H2,1H3,(H,23,24)