1-[(5-chloranylthiophen-2-yl)-(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-chloranylthiophen-2-yl)-(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-chloro-2-thienyl)-(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-chloro-2-thiophenyl)-(2-methoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-chlorothiophen-2-yl)-(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-chloro-2-thienyl)-(2-methoxyphenyl)methyl]proline Formula: C17H18ClNO3S MolecularWeight: 351.84772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(C2=CC=C(S2)Cl)N3CCCC3C(=O)O

Isomeric SMILES

COC1=CC=CC=C1C(C2=CC=C(S2)Cl)N3CCCC3C(=O)O

InChI

InChI=1S/C17H18ClNO3S/c1-22-13-7-3-2-5-11(13)16(14-8-9-15(18)23-14)19-10-4-6-12(19)17(20)21/h2-3,5,7-9,12,16H,4,6,10H2,1H3,(H,20,21)