1-[(3-methylpyridin-4-yl)-thiophen-2-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-methylpyridin-4-yl)-thiophen-2-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-methyl-4-pyridyl)-(2-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-methyl-4-pyridinyl)-thiophen-2-ylmethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-methylpyridin-4-yl)-thiophen-2-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3-methyl-4-pyridyl)-(2-thienyl)methyl]proline Formula: C16H18N2O2S MolecularWeight: 302.39132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)C(C2=CC=CS2)N3CCCC3C(=O)O

Isomeric SMILES

CC1=C(C=CN=C1)C(C2=CC=CS2)N3CCCC3C(=O)O

InChI

InChI=1S/C16H18N2O2S/c1-11-10-17-7-6-12(11)15(14-5-3-9-21-14)18-8-2-4-13(18)16(19)20/h3,5-7,9-10,13,15H,2,4,8H2,1H3,(H,19,20)