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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=NC3=CC=CC=C3C=C2)C4=CC=C(S4)Br)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=NC3=CC=CC=C3C=C2)C4=CC=C(S4)Br)C(=O)O

InChI

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