N-(3-chloranyl-4-cyano-phenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-(3-chloro-4-cyanophenyl)-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C22H20ClN3O2 MolecularWeight: 393.8661

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC(=C(C=C2)C#N)Cl)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC(=C(C=C2)C#N)Cl)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H20ClN3O2/c23-20-14-19(8-7-18(20)15-24)25-22(28)17-10-12-26(13-11-17)21(27)9-6-16-4-2-1-3-5-16/h1-9,14,17H,10-13H2,(H,25,28)/b9-6+