N-[5-chloranyl-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-phenyl]-1-phenyl-piperidine-4-carboxamide

Systemtic Name: N-[5-chloranyl-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-phenyl]-1-phenyl-piperidine-4-carboxamide Openeye Name: N-[5-chloro-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-phenyl]-1-phenyl-piperidine-4-carboxamide CAS Name: N-[5-chloro-4-[(4-chlorophenyl)-cyanomethyl]-2-methylphenyl]-1-phenyl-4-piperidinecarboxamide IUPAC Name: N-[5-chloro-4-[(4-chlorophenyl)-cyanomethyl]-2-methylphenyl]-1-phenylpiperidine-4-carboxamide Traditional Name: N-[5-chloro-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-phenyl]-1-phenyl-isonipecotamide Formula: C27H25Cl2N3O MolecularWeight: 478.4129

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C2CCN(CC2)C3=CC=CC=C3)Cl)C(C#N)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C2CCN(CC2)C3=CC=CC=C3)Cl)C(C#N)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H25Cl2N3O/c1-18-15-23(24(17-30)19-7-9-21(28)10-8-19)25(29)16-26(18)31-27(33)20-11-13-32(14-12-20)22-5-3-2-4-6-22/h2-10,15-16,20,24H,11-14H2,1H3,(H,31,33)