1-[(5-methylthiophen-2-yl)-(2-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-methylthiophen-2-yl)-(2-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2-benzyloxyphenyl)-(5-methyl-2-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-methyl-2-thiophenyl)-(2-phenylmethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-methylthiophen-2-yl)-(2-phenylmethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2-benzoxyphenyl)-(5-methyl-2-thienyl)methyl]proline Formula: C24H25NO3S MolecularWeight: 407.5252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C2=CC=CC=C2OCC3=CC=CC=C3)N4CCCC4C(=O)O

Isomeric SMILES

CC1=CC=C(S1)C(C2=CC=CC=C2OCC3=CC=CC=C3)N4CCCC4C(=O)O

InChI

InChI=1S/C24H25NO3S/c1-17-13-14-22(29-17)23(25-15-7-11-20(25)24(26)27)19-10-5-6-12-21(19)28-16-18-8-3-2-4-9-18/h2-6,8-10,12-14,20,23H,7,11,15-16H2,1H3,(H,26,27)