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

Systemtic Name: 1-[(4-methylthiophen-2-yl)-(4-propan-2-ylphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-isopropylphenyl)-(4-methyl-2-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(4-methyl-2-thiophenyl)-(4-propan-2-ylphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-methylthiophen-2-yl)-(4-propan-2-ylphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-methyl-2-thienyl)-p-cumenyl-methyl]proline Formula: C20H25NO2S MolecularWeight: 343.483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO2S/c1-13(2)15-6-8-16(9-7-15)19(18-11-14(3)12-24-18)21-10-4-5-17(21)20(22)23/h6-9,11-13,17,19H,4-5,10H2,1-3H3,(H,22,23)