N-[4-(cyanomethyl)phenyl]-1-[(2,4-dichlorophenyl)methyl]piperidine-3-carboxamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-1-[(2,4-dichlorophenyl)methyl]piperidine-3-carboxamide Openeye Name: N-[4-(cyanomethyl)phenyl]-1-[(2,4-dichlorophenyl)methyl]piperidine-3-carboxamide CAS Name: N-[4-(cyanomethyl)phenyl]-1-[(2,4-dichlorophenyl)methyl]-3-piperidinecarboxamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-1-[(2,4-dichlorophenyl)methyl]piperidine-3-carboxamide Traditional Name: N-[4-(cyanomethyl)phenyl]-1-(2,4-dichlorobenzyl)nipecotamide Formula: C21H21Cl2N3O MolecularWeight: 402.31694

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=C(C=C(C=C2)Cl)Cl)C(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

C1CC(CN(C1)CC2=C(C=C(C=C2)Cl)Cl)C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C21H21Cl2N3O/c22-18-6-5-16(20(23)12-18)13-26-11-1-2-17(14-26)21(27)25-19-7-3-15(4-8-19)9-10-24/h3-8,12,17H,1-2,9,11,13-14H2,(H,25,27)