1-[(E)-3-carboxy-4-phenyl-but-3-enoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(E)-3-carboxy-4-phenyl-but-3-enoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(E)-3-carboxy-4-phenyl-but-3-enoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(E)-3-carboxy-1-oxo-4-phenylbut-3-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(E)-3-carboxy-4-phenylbut-3-enoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(E)-3-carboxy-4-phenyl-but-3-enoyl]proline Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1CC(N(C1)C(=O)C/C(=C\C2=CC=CC=C2)/C(=O)O)C(=O)O

InChI

InChI=1S/C16H17NO5/c18-14(17-8-4-7-13(17)16(21)22)10-12(15(19)20)9-11-5-2-1-3-6-11/h1-3,5-6,9,13H,4,7-8,10H2,(H,19,20)(H,21,22)/b12-9+