ethyl 1-(3-acetamidopropanoyl)-3-[(4-fluorophenyl)methyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-(3-acetamidopropanoyl)-3-[(4-fluorophenyl)methyl]piperidine-3-carboxylate Openeye Name: ethyl 1-(3-acetamidopropanoyl)-3-[(4-fluorophenyl)methyl]piperidine-3-carboxylate CAS Name: 1-(3-acetamido-1-oxopropyl)-3-[(4-fluorophenyl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-acetamidopropanoyl)-3-[(4-fluorophenyl)methyl]piperidine-3-carboxylate Traditional Name: 1-(3-acetamidopropanoyl)-3-(4-fluorobenzyl)nipecotic acid ethyl ester Formula: C20H27FN2O4 MolecularWeight: 378.437783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)CCNC(=O)C)CC2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)CCNC(=O)C)CC2=CC=C(C=C2)F

InChI

InChI=1S/C20H27FN2O4/c1-3-27-19(26)20(13-16-5-7-17(21)8-6-16)10-4-12-23(14-20)18(25)9-11-22-15(2)24/h5-8H,3-4,9-14H2,1-2H3,(H,22,24)