tert-butyl N-[3-[4-(2-chlorophenyl)-4-cyano-piperidin-1-yl]propyl]carbamate

Systemtic Name: tert-butyl N-[3-[4-(2-chlorophenyl)-4-cyano-piperidin-1-yl]propyl]carbamate Openeye Name: tert-butyl N-[3-[4-(2-chlorophenyl)-4-cyano-1-piperidyl]propyl]carbamate CAS Name: N-[3-[4-(2-chlorophenyl)-4-cyano-1-piperidinyl]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[4-(2-chlorophenyl)-4-cyanopiperidin-1-yl]propyl]carbamate Traditional Name: N-[3-[4-(2-chlorophenyl)-4-cyano-piperidino]propyl]carbamic acid tert-butyl ester Formula: C20H28ClN3O2 MolecularWeight: 377.90822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCN1CCC(CC1)(C#N)C2=CC=CC=C2Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCCCN1CCC(CC1)(C#N)C2=CC=CC=C2Cl

InChI

InChI=1S/C20H28ClN3O2/c1-19(2,3)26-18(25)23-11-6-12-24-13-9-20(15-22,10-14-24)16-7-4-5-8-17(16)21/h4-5,7-8H,6,9-14H2,1-3H3,(H,23,25)