tert-butyl 4-[2-cyano-3-ethoxy-1-(4-fluoranyl-2-methyl-phenyl)-3-oxidanylidene-propyl]-4-fluoranyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-cyano-3-ethoxy-1-(4-fluoranyl-2-methyl-phenyl)-3-oxidanylidene-propyl]-4-fluoranyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-cyano-3-ethoxy-1-(4-fluoro-2-methyl-phenyl)-3-oxo-propyl]-4-fluoro-piperidine-1-carboxylate CAS Name: 4-[2-cyano-3-ethoxy-1-(4-fluoro-2-methylphenyl)-3-oxopropyl]-4-fluoro-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-cyano-3-ethoxy-1-(4-fluoro-2-methylphenyl)-3-oxopropyl]-4-fluoropiperidine-1-carboxylate Traditional Name: 4-[2-cyano-3-ethoxy-1-(4-fluoro-2-methyl-phenyl)-3-keto-propyl]-4-fluoro-piperidine-1-carboxylic acid tert-butyl ester Formula: C23H30F2N2O4 MolecularWeight: 436.492106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(C1=C(C=C(C=C1)F)C)C2(CCN(CC2)C(=O)OC(C)(C)C)F

Isomeric SMILES

CCOC(=O)C(C#N)C(C1=C(C=C(C=C1)F)C)C2(CCN(CC2)C(=O)OC(C)(C)C)F

InChI

InChI=1S/C23H30F2N2O4/c1-6-30-20(28)18(14-26)19(17-8-7-16(24)13-15(17)2)23(25)9-11-27(12-10-23)21(29)31-22(3,4)5/h7-8,13,18-19H,6,9-12H2,1-5H3