ethyl 1-[2-(4-chlorophenyl)-4-cyano-1,3-oxazol-5-yl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(4-chlorophenyl)-4-cyano-1,3-oxazol-5-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(4-chlorophenyl)-4-cyano-oxazol-5-yl]piperidine-3-carboxylate CAS Name: 1-[2-(4-chlorophenyl)-4-cyano-5-oxazolyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-chlorophenyl)-4-cyano-1,3-oxazol-5-yl]piperidine-3-carboxylate Traditional Name: 1-[2-(4-chlorophenyl)-4-cyano-oxazol-5-yl]nipecotic acid ethyl ester Formula: C18H18ClN3O3 MolecularWeight: 359.80682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=C(N=C(O2)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2=C(N=C(O2)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C18H18ClN3O3/c1-2-24-18(23)13-4-3-9-22(11-13)17-15(10-20)21-16(25-17)12-5-7-14(19)8-6-12/h5-8,13H,2-4,9,11H2,1H3