1-[(E)-3-(2-chloranyl-6-fluoranyl-phenyl)prop-2-enoyl]-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[(E)-3-(2-chloranyl-6-fluoranyl-phenyl)prop-2-enoyl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-[(E)-3-(2-chloro-6-fluoro-phenyl)prop-2-enoyl]piperidine-4-carboxamide CAS Name: 1-[(E)-3-(2-chloro-6-fluorophenyl)-1-oxoprop-2-enyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[(E)-3-(2-chloro-6-fluorophenyl)prop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-[(E)-3-(2-chloro-6-fluoro-phenyl)acryloyl]isonipecotamide Formula: C22H22ClFN2O2 MolecularWeight: 400.873683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CC=C2)C(=O)C=CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CC=C2)C(=O)/C=C/C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C22H22ClFN2O2/c23-19-7-4-8-20(24)18(19)9-10-21(27)26-13-11-17(12-14-26)22(28)25-15-16-5-2-1-3-6-16/h1-10,17H,11-15H2,(H,25,28)/b10-9+