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

Systemtic Name: 1-[(2,5-dimethylphenyl)-(5-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2,5-dimethylphenyl)-(5-methyl-2-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,5-dimethylphenyl)-(5-methyl-2-thiophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,5-dimethylphenyl)-(5-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2,5-dimethylphenyl)-(5-methyl-2-thienyl)methyl]proline Formula: C19H23NO2S MolecularWeight: 329.45642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C2=CC=C(S2)C)N3CCCC3C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(C2=CC=C(S2)C)N3CCCC3C(=O)O

InChI

InChI=1S/C19H23NO2S/c1-12-6-7-13(2)15(11-12)18(17-9-8-14(3)23-17)20-10-4-5-16(20)19(21)22/h6-9,11,16,18H,4-5,10H2,1-3H3,(H,21,22)