(2S)-1-[(2R)-3-phenyl-2-[(phenylmethyl)sulfonylamino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2R)-3-phenyl-2-[(phenylmethyl)sulfonylamino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2R)-2-(benzylsulfonylamino)-3-phenyl-propanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2R)-1-oxo-3-phenyl-2-[(phenylmethyl)sulfonylamino]propyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2R)-2-(benzylsulfonylamino)-3-phenylpropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2R)-2-(benzylsulfonylamino)-3-phenyl-propanoyl]proline Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)NS(=O)(=O)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1C[C@H](N(C1)C(=O)[C@@H](CC2=CC=CC=C2)NS(=O)(=O)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H24N2O5S/c24-20(23-13-7-12-19(23)21(25)26)18(14-16-8-3-1-4-9-16)22-29(27,28)15-17-10-5-2-6-11-17/h1-6,8-11,18-19,22H,7,12-15H2,(H,25,26)/t18-,19+/m1/s1