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

Systemtic Name: 1-[(3-methylphenyl)-thiophen-3-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[m-tolyl(3-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-methylphenyl)-(3-thiophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-methylphenyl)-thiophen-3-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[m-tolyl(3-thienyl)methyl]proline Formula: C17H19NO2S MolecularWeight: 301.40326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO2S/c1-12-4-2-5-13(10-12)16(14-7-9-21-11-14)18-8-3-6-15(18)17(19)20/h2,4-5,7,9-11,15-16H,3,6,8H2,1H3,(H,19,20)