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

Systemtic Name: 1-[(4-ethylphenyl)-(4-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-ethylphenyl)-(4-methyl-2-thienyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(4-ethylphenyl)-(4-methyl-2-thiophenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-ethylphenyl)-(4-methylthiophen-2-yl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-ethylphenyl)-(4-methyl-2-thienyl)methyl]proline Formula: C19H23NO2S MolecularWeight: 329.45642

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC(=CS2)C)N3CCCC3C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC(=CS2)C)N3CCCC3C(=O)O

InChI

InChI=1S/C19H23NO2S/c1-3-14-6-8-15(9-7-14)18(17-11-13(2)12-23-17)20-10-4-5-16(20)19(21)22/h6-9,11-12,16,18H,3-5,10H2,1-2H3,(H,21,22)