4-(4-phenylphenoxy)-1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(4-phenylphenoxy)-1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-(4-phenylphenoxy)-1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-(3-mercapto-1-oxopropyl)-4-(4-phenylphenoxy)-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(4-phenylphenoxy)-1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(3-mercaptopropanoyl)-4-(4-phenylphenoxy)proline Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)O)C(=O)CCS)OC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

C1C(CN(C1C(=O)O)C(=O)CCS)OC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H21NO4S/c22-19(10-11-26)21-13-17(12-18(21)20(23)24)25-16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-9,17-18,26H,10-13H2,(H,23,24)