1-[(3-bromophenyl)-pyridin-4-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-bromophenyl)-pyridin-4-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-bromophenyl)-(4-pyridyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-bromophenyl)-pyridin-4-ylmethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-bromophenyl)-pyridin-4-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3-bromophenyl)-(4-pyridyl)methyl]proline Formula: C17H17BrN2O2 MolecularWeight: 361.23308

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CC=NC=C2)C3=CC(=CC=C3)Br)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CC=NC=C2)C3=CC(=CC=C3)Br)C(=O)O

InChI

InChI=1S/C17H17BrN2O2/c18-14-4-1-3-13(11-14)16(12-6-8-19-9-7-12)20-10-2-5-15(20)17(21)22/h1,3-4,6-9,11,15-16H,2,5,10H2,(H,21,22)