1-[(3-methylthiophen-2-yl)-quinolin-3-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-methylthiophen-2-yl)-quinolin-3-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-methyl-2-thienyl)-(3-quinolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-methyl-2-thiophenyl)-(3-quinolinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-methylthiophen-2-yl)-quinolin-3-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3-methyl-2-thienyl)-(3-quinolyl)methyl]proline Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C2=CC3=CC=CC=C3N=C2)N4CCCC4C(=O)O

Isomeric SMILES

CC1=C(SC=C1)C(C2=CC3=CC=CC=C3N=C2)N4CCCC4C(=O)O

InChI

InChI=1S/C20H20N2O2S/c1-13-8-10-25-19(13)18(22-9-4-7-17(22)20(23)24)15-11-14-5-2-3-6-16(14)21-12-15/h2-3,5-6,8,10-12,17-18H,4,7,9H2,1H3,(H,23,24)