1-[(3-methylphenyl)-(3-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-methylphenyl)-(3-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-methyl-2-thienyl)-(m-tolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-methylphenyl)-(3-methyl-2-thiophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-methylphenyl)-(3-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3-methyl-2-thienyl)-(m-tolyl)methyl]proline Formula: C18H21NO2S MolecularWeight: 315.42984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=C(C=CS2)C)N3CCCC3C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=C(C=CS2)C)N3CCCC3C(=O)O

InChI

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