4-oxidanyl-1-phenylmethoxycarbonyl-4-(4-phenylsulfanylphenyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 4-oxidanyl-1-phenylmethoxycarbonyl-4-(4-phenylsulfanylphenyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-benzyloxycarbonyl-4-hydroxy-4-(4-phenylsulfanylphenyl)pyrrolidine-2-carboxylic acid CAS Name: 4-hydroxy-1-phenylmethoxycarbonyl-4-[4-(phenylthio)phenyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-hydroxy-1-phenylmethoxycarbonyl-4-(4-phenylsulfanylphenyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-carbobenzoxy-4-hydroxy-4-[4-(phenylthio)phenyl]proline Formula: C25H23NO5S MolecularWeight: 449.51882

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC1(C2=CC=C(C=C2)SC3=CC=CC=C3)O)C(=O)OCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1C(N(CC1(C2=CC=C(C=C2)SC3=CC=CC=C3)O)C(=O)OCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C25H23NO5S/c27-23(28)22-15-25(30,17-26(22)24(29)31-16-18-7-3-1-4-8-18)19-11-13-21(14-12-19)32-20-9-5-2-6-10-20/h1-14,22,30H,15-17H2,(H,27,28)