(2R)-1-[5-[2-(4-methylphenyl)ethynyl]thiophen-2-yl]sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: (2R)-1-[5-[2-(4-methylphenyl)ethynyl]thiophen-2-yl]sulfonylpyrrolidine-2-carboxylic acid Openeye Name: (2R)-1-[[5-[2-(p-tolyl)ethynyl]-2-thienyl]sulfonyl]pyrrolidine-2-carboxylic acid CAS Name: (2R)-1-[[5-[2-(4-methylphenyl)ethynyl]-2-thiophenyl]sulfonyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2R)-1-[5-[2-(4-methylphenyl)ethynyl]thiophen-2-yl]sulfonylpyrrolidine-2-carboxylic acid Traditional Name: (2R)-1-[[5-[2-(p-tolyl)ethynyl]-2-thienyl]sulfonyl]proline Formula: C18H17NO4S2 MolecularWeight: 375.46188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC2=CC=C(S2)S(=O)(=O)N3CCCC3C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C#CC2=CC=C(S2)S(=O)(=O)N3CCC[C@@H]3C(=O)O

InChI

InChI=1S/C18H17NO4S2/c1-13-4-6-14(7-5-13)8-9-15-10-11-17(24-15)25(22,23)19-12-2-3-16(19)18(20)21/h4-7,10-11,16H,2-3,12H2,1H3,(H,20,21)/t16-/m1/s1