1-[(5-ethylthiophen-2-yl)-phenyl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-ethylthiophen-2-yl)-phenyl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-ethyl-2-thienyl)-phenyl-methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-ethyl-2-thiophenyl)-phenylmethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-ethylthiophen-2-yl)-phenylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-ethyl-2-thienyl)-phenyl-methyl]proline Formula: C18H21NO2S MolecularWeight: 315.42984

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(C2=CC=CC=C2)N3CCCC3C(=O)O

Isomeric SMILES

CCC1=CC=C(S1)C(C2=CC=CC=C2)N3CCCC3C(=O)O

InChI

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