1-[(2-ethoxyphenyl)-thiophen-2-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2-ethoxyphenyl)-thiophen-2-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2-ethoxyphenyl)-(2-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-ethoxyphenyl)-thiophen-2-ylmethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-ethoxyphenyl)-thiophen-2-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[o-phenetyl(2-thienyl)methyl]proline Formula: C18H21NO3S MolecularWeight: 331.42924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(C2=CC=CS2)N3CCCC3C(=O)O

Isomeric SMILES

CCOC1=CC=CC=C1C(C2=CC=CS2)N3CCCC3C(=O)O

InChI

InChI=1S/C18H21NO3S/c1-2-22-15-9-4-3-7-13(15)17(16-10-6-12-23-16)19-11-5-8-14(19)18(20)21/h3-4,6-7,9-10,12,14,17H,2,5,8,11H2,1H3,(H,20,21)