1-[(E)-3-(3-chloranyl-4-fluoranyl-phenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(E)-3-(3-chloranyl-4-fluoranyl-phenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(E)-3-(3-chloro-4-fluoro-phenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(E)-3-(3-chloro-4-fluorophenyl)-1-oxoprop-2-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(E)-3-(3-chloro-4-fluorophenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(E)-3-(3-chloro-4-fluoro-phenyl)acryloyl]proline Formula: C14H13ClFNO3 MolecularWeight: 297.709323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1CC(N(C1)C(=O)/C=C/C2=CC(=C(C=C2)F)Cl)C(=O)O

InChI

InChI=1S/C14H13ClFNO3/c15-10-8-9(3-5-11(10)16)4-6-13(18)17-7-1-2-12(17)14(19)20/h3-6,8,12H,1-2,7H2,(H,19,20)/b6-4+