(2R,4R,5R)-4-cyano-5-(3-ethylpentanoyl)-1-(phenylmethyl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2R,4R,5R)-4-cyano-5-(3-ethylpentanoyl)-1-(phenylmethyl)pyrrolidine-2-carboxylic acid Openeye Name: (2R,4R,5R)-1-benzyl-4-cyano-5-(3-ethylpentanoyl)pyrrolidine-2-carboxylic acid CAS Name: (2R,4R,5R)-4-cyano-5-(3-ethyl-1-oxopentyl)-1-(phenylmethyl)-2-pyrrolidinecarboxylic acid IUPAC Name: (2R,4R,5R)-1-benzyl-4-cyano-5-(3-ethylpentanoyl)pyrrolidine-2-carboxylic acid Traditional Name: (2R,4R,5R)-1-benzyl-4-cyano-5-(3-ethylpentanoyl)proline Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CC(=O)C1C(CC(N1CC2=CC=CC=C2)C(=O)O)C#N

Isomeric SMILES

CCC(CC)CC(=O)[C@H]1[C@@H](C[C@@H](N1CC2=CC=CC=C2)C(=O)O)C#N

InChI

InChI=1S/C20H26N2O3/c1-3-14(4-2)10-18(23)19-16(12-21)11-17(20(24)25)22(19)13-15-8-6-5-7-9-15/h5-9,14,16-17,19H,3-4,10-11,13H2,1-2H3,(H,24,25)/t16-,17+,19+/m0/s1