(2S)-1-[(2R)-2-acetamido-2-phenyl-ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2R)-2-acetamido-2-phenyl-ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2R)-2-acetamido-2-phenyl-acetyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2R)-2-acetamido-1-oxo-2-phenylethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2R)-2-acetamido-2-phenylacetyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2R)-2-acetamido-2-phenyl-acetyl]proline Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C1=CC=CC=C1)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CC(=O)N[C@H](C1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)O

InChI

InChI=1S/C15H18N2O4/c1-10(18)16-13(11-6-3-2-4-7-11)14(19)17-9-5-8-12(17)15(20)21/h2-4,6-7,12-13H,5,8-9H2,1H3,(H,16,18)(H,20,21)/t12-,13+/m0/s1