1-[1-(5-bromanylthiophen-2-yl)-2-pyridin-2-yl-ethyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[1-(5-bromanylthiophen-2-yl)-2-pyridin-2-yl-ethyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[1-(5-bromo-2-thienyl)-2-(2-pyridyl)ethyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[1-(5-bromo-2-thiophenyl)-2-(2-pyridinyl)ethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[1-(5-bromothiophen-2-yl)-2-pyridin-2-ylethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[1-(5-bromo-2-thienyl)-2-(2-pyridyl)ethyl]proline Formula: C16H17BrN2O2S MolecularWeight: 381.28738

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(CC2=CC=CC=N2)C3=CC=C(S3)Br)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(CC2=CC=CC=N2)C3=CC=C(S3)Br)C(=O)O

InChI

InChI=1S/C16H17BrN2O2S/c17-15-7-6-14(22-15)13(10-11-4-1-2-8-18-11)19-9-3-5-12(19)16(20)21/h1-2,4,6-8,12-13H,3,5,9-10H2,(H,20,21)