ethyl 2-[4-cyano-4-(3-cyclobutyloxy-4-methoxy-phenyl)piperidin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-cyano-4-(3-cyclobutyloxy-4-methoxy-phenyl)piperidin-1-yl]ethanoate Openeye Name: ethyl 2-[4-cyano-4-[3-(cyclobutoxy)-4-methoxy-phenyl]-1-piperidyl]acetate CAS Name: 2-[4-cyano-4-(3-cyclobutyloxy-4-methoxyphenyl)-1-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-cyano-4-(3-cyclobutyloxy-4-methoxyphenyl)piperidin-1-yl]acetate Traditional Name: 2-[4-cyano-4-[3-(cyclobutoxy)-4-methoxy-phenyl]piperidino]acetic acid ethyl ester Formula: C21H28N2O4 MolecularWeight: 372.45802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCC(CC1)(C#N)C2=CC(=C(C=C2)OC)OC3CCC3

Isomeric SMILES

CCOC(=O)CN1CCC(CC1)(C#N)C2=CC(=C(C=C2)OC)OC3CCC3

InChI

InChI=1S/C21H28N2O4/c1-3-26-20(24)14-23-11-9-21(15-22,10-12-23)16-7-8-18(25-2)19(13-16)27-17-5-4-6-17/h7-8,13,17H,3-6,9-12,14H2,1-2H3