ethyl 1-[2-(diethylamino)ethanoyl]-3-[(4-fluorophenyl)methyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(diethylamino)ethanoyl]-3-[(4-fluorophenyl)methyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(diethylamino)acetyl]-3-[(4-fluorophenyl)methyl]piperidine-3-carboxylate CAS Name: 1-[2-(diethylamino)-1-oxoethyl]-3-[(4-fluorophenyl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(diethylamino)acetyl]-3-[(4-fluorophenyl)methyl]piperidine-3-carboxylate Traditional Name: 1-[2-(diethylamino)acetyl]-3-(4-fluorobenzyl)nipecotic acid ethyl ester Formula: C21H31FN2O3 MolecularWeight: 378.480843

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(=O)N1CCCC(C1)(CC2=CC=C(C=C2)F)C(=O)OCC

Isomeric SMILES

CCN(CC)CC(=O)N1CCCC(C1)(CC2=CC=C(C=C2)F)C(=O)OCC

InChI

InChI=1S/C21H31FN2O3/c1-4-23(5-2)15-19(25)24-13-7-12-21(16-24,20(26)27-6-3)14-17-8-10-18(22)11-9-17/h8-11H,4-7,12-16H2,1-3H3