tert-butyl 3-[(E)-3-ethoxy-1-(4-fluorophenyl)-3-oxidanylidene-prop-1-enyl]-3-fluoranyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(E)-3-ethoxy-1-(4-fluorophenyl)-3-oxidanylidene-prop-1-enyl]-3-fluoranyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[(E)-3-ethoxy-1-(4-fluorophenyl)-3-oxo-prop-1-enyl]-3-fluoro-pyrrolidine-1-carboxylate CAS Name: 3-[(E)-3-ethoxy-1-(4-fluorophenyl)-3-oxoprop-1-enyl]-3-fluoro-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(E)-3-ethoxy-1-(4-fluorophenyl)-3-oxoprop-1-enyl]-3-fluoropyrrolidine-1-carboxylate Traditional Name: 3-[(E)-3-ethoxy-1-(4-fluorophenyl)-3-keto-prop-1-enyl]-3-fluoro-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C20H25F2NO4 MolecularWeight: 381.413606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C1=CC=C(C=C1)F)C2(CCN(C2)C(=O)OC(C)(C)C)F

Isomeric SMILES

CCOC(=O)/C=C(\C1=CC=C(C=C1)F)/C2(CCN(C2)C(=O)OC(C)(C)C)F

InChI

InChI=1S/C20H25F2NO4/c1-5-26-17(24)12-16(14-6-8-15(21)9-7-14)20(22)10-11-23(13-20)18(25)27-19(2,3)4/h6-9,12H,5,10-11,13H2,1-4H3/b16-12+