[1-chloranyl-1-(4-chloranyl-2,6-dimethyl-piperidin-1-yl)-2-cyano-propan-2-yl] 3-phenylpropanoate

Systemtic Name: [1-chloranyl-1-(4-chloranyl-2,6-dimethyl-piperidin-1-yl)-2-cyano-propan-2-yl] 3-phenylpropanoate Openeye Name: [2-chloro-2-(4-chloro-2,6-dimethyl-1-piperidyl)-1-cyano-1-methyl-ethyl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [1-chloro-1-(4-chloro-2,6-dimethyl-1-piperidinyl)-2-cyanopropan-2-yl] ester IUPAC Name: [1-chloro-1-(4-chloro-2,6-dimethylpiperidin-1-yl)-2-cyanopropan-2-yl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [2-chloro-2-(4-chloro-2,6-dimethyl-piperidino)-1-cyano-1-methyl-ethyl] ester Formula: C20H26Cl2N2O2 MolecularWeight: 397.33864

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(N1C(C(C)(C#N)OC(=O)CCC2=CC=CC=C2)Cl)C)Cl

Isomeric SMILES

CC1CC(CC(N1C(C(C)(C#N)OC(=O)CCC2=CC=CC=C2)Cl)C)Cl

InChI

InChI=1S/C20H26Cl2N2O2/c1-14-11-17(21)12-15(2)24(14)19(22)20(3,13-23)26-18(25)10-9-16-7-5-4-6-8-16/h4-8,14-15,17,19H,9-12H2,1-3H3