(2R,4S)-4-ethanoyl-1-(phenylmethyl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2R,4S)-4-ethanoyl-1-(phenylmethyl)pyrrolidine-2-carboxylic acid Openeye Name: (2R,4S)-4-acetyl-1-benzyl-pyrrolidine-2-carboxylic acid CAS Name: (2R,4S)-4-acetyl-1-(phenylmethyl)-2-pyrrolidinecarboxylic acid IUPAC Name: (2R,4S)-4-acetyl-1-benzylpyrrolidine-2-carboxylic acid Traditional Name: (2R,4S)-4-acetyl-1-benzyl-proline Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CC(N(C1)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(=O)[C@H]1C[C@@H](N(C1)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C14H17NO3/c1-10(16)12-7-13(14(17)18)15(9-12)8-11-5-3-2-4-6-11/h2-6,12-13H,7-9H2,1H3,(H,17,18)/t12-,13+/m0/s1