5-(1-acetamido-2-oxidanyl-4-phenyl-but-3-ynyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(1-acetamido-2-oxidanyl-4-phenyl-but-3-ynyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Openeye Name: 5-(1-acetamido-2-hydroxy-4-phenyl-but-3-ynyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid CAS Name: 5-(1-acetamido-2-hydroxy-4-phenylbut-3-ynyl)-4-[(E)-prop-1-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(1-acetamido-2-hydroxy-4-phenylbut-3-ynyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Traditional Name: 5-(1-acetamido-2-hydroxy-4-phenyl-but-3-ynyl)-4-[(E)-prop-1-enyl]proline Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1CC(NC1C(C(C#CC2=CC=CC=C2)O)NC(=O)C)C(=O)O

Isomeric SMILES

C/C=C/C1CC(NC1C(C(C#CC2=CC=CC=C2)O)NC(=O)C)C(=O)O

InChI

InChI=1S/C20H24N2O4/c1-3-7-15-12-16(20(25)26)22-18(15)19(21-13(2)23)17(24)11-10-14-8-5-4-6-9-14/h3-9,15-19,22,24H,12H2,1-2H3,(H,21,23)(H,25,26)/b7-3+