5-(1-acetamido-3-cyano-2-oxidanyl-propyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(1-acetamido-3-cyano-2-oxidanyl-propyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Openeye Name: 5-(1-acetamido-3-cyano-2-hydroxy-propyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid CAS Name: 5-(1-acetamido-3-cyano-2-hydroxypropyl)-4-[(E)-prop-1-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(1-acetamido-3-cyano-2-hydroxypropyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Traditional Name: 5-(1-acetamido-3-cyano-2-hydroxy-propyl)-4-[(E)-prop-1-enyl]proline Formula: C14H21N3O4 MolecularWeight: 295.33424

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1CC(NC1C(C(CC#N)O)NC(=O)C)C(=O)O

Isomeric SMILES

C/C=C/C1CC(NC1C(C(CC#N)O)NC(=O)C)C(=O)O

InChI

InChI=1S/C14H21N3O4/c1-3-4-9-7-10(14(20)21)17-12(9)13(16-8(2)18)11(19)5-6-15/h3-4,9-13,17,19H,5,7H2,1-2H3,(H,16,18)(H,20,21)/b4-3+