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

Systemtic Name: methyl 1-[(E)-3-(3-chloranyl-4-fluoranyl-phenyl)prop-2-enoyl]pyrrolidine-2-carboxylate Openeye Name: methyl 1-[(E)-3-(3-chloro-4-fluoro-phenyl)prop-2-enoyl]pyrrolidine-2-carboxylate CAS Name: 1-[(E)-3-(3-chloro-4-fluorophenyl)-1-oxoprop-2-enyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(E)-3-(3-chloro-4-fluorophenyl)prop-2-enoyl]pyrrolidine-2-carboxylate Traditional Name: 1-[(E)-3-(3-chloro-4-fluoro-phenyl)acryloyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C15H15ClFNO3 MolecularWeight: 311.735903

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(=O)C=CC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

COC(=O)C1CCCN1C(=O)/C=C/C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C15H15ClFNO3/c1-21-15(20)13-3-2-8-18(13)14(19)7-5-10-4-6-12(17)11(16)9-10/h4-7,9,13H,2-3,8H2,1H3/b7-5+