1-cyanoethyl 1-(4-fluorophenyl)carbonylpiperidine-3-carboxylate

Systemtic Name: 1-cyanoethyl 1-(4-fluorophenyl)carbonylpiperidine-3-carboxylate Openeye Name: 1-cyanoethyl 1-(4-fluorobenzoyl)piperidine-3-carboxylate CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-3-piperidinecarboxylic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl 1-(4-fluorobenzoyl)piperidine-3-carboxylate Traditional Name: 1-(4-fluorobenzoyl)nipecotic acid 1-cyanoethyl ester Formula: C16H17FN2O3 MolecularWeight: 304.316183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C#N)OC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H17FN2O3/c1-11(9-18)22-16(21)13-3-2-8-19(10-13)15(20)12-4-6-14(17)7-5-12/h4-7,11,13H,2-3,8,10H2,1H3