1-[(5-bromanylthiophen-2-yl)-quinolin-4-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-bromanylthiophen-2-yl)-quinolin-4-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-bromo-2-thienyl)-(4-quinolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-bromo-2-thiophenyl)-(4-quinolinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-bromothiophen-2-yl)-quinolin-4-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-bromo-2-thienyl)-(4-quinolyl)methyl]proline Formula: C19H17BrN2O2S MolecularWeight: 417.31948

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CC=NC3=CC=CC=C23)C4=CC=C(S4)Br)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CC=NC3=CC=CC=C23)C4=CC=C(S4)Br)C(=O)O

InChI

InChI=1S/C19H17BrN2O2S/c20-17-8-7-16(25-17)18(22-11-3-6-15(22)19(23)24)13-9-10-21-14-5-2-1-4-12(13)14/h1-2,4-5,7-10,15,18H,3,6,11H2,(H,23,24)