1-[(2-methylphenyl)-(4-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2-methylphenyl)-(4-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-methyl-2-thienyl)-(o-tolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-methylphenyl)-(4-methyl-2-thiophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-methylphenyl)-(4-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-methyl-2-thienyl)-(o-tolyl)methyl]proline Formula: C18H21NO2S MolecularWeight: 315.42984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC(=CS2)C)N3CCCC3C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC(=CS2)C)N3CCCC3C(=O)O

InChI

InChI=1S/C18H21NO2S/c1-12-10-16(22-11-12)17(14-7-4-3-6-13(14)2)19-9-5-8-15(19)18(20)21/h3-4,6-7,10-11,15,17H,5,8-9H2,1-2H3,(H,20,21)