1-[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[(E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[(E)-3-(5-bromo-2-fluorophenyl)-1-oxoprop-2-enyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[(E)-3-(5-bromo-2-fluoro-phenyl)acryloyl]-N-phenyl-isonipecotamide Formula: C21H20BrFN2O2 MolecularWeight: 431.298103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)C=CC3=C(C=CC(=C3)Br)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)/C=C/C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C21H20BrFN2O2/c22-17-7-8-19(23)16(14-17)6-9-20(26)25-12-10-15(11-13-25)21(27)24-18-4-2-1-3-5-18/h1-9,14-15H,10-13H2,(H,24,27)/b9-6+