1-[(4-methylphenyl)-thiophen-3-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(4-methylphenyl)-thiophen-3-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[p-tolyl(3-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(4-methylphenyl)-(3-thiophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-methylphenyl)-thiophen-3-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[p-tolyl(3-thienyl)methyl]proline Formula: C17H19NO2S MolecularWeight: 301.40326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO2S/c1-12-4-6-13(7-5-12)16(14-8-10-21-11-14)18-9-2-3-15(18)17(19)20/h4-8,10-11,15-16H,2-3,9H2,1H3,(H,19,20)