N-[1-[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]piperidin-4-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[1-[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]piperidin-4-yl]-4-fluoranyl-benzamide Openeye Name: N-[1-[(E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoyl]-4-piperidyl]-4-fluoro-benzamide CAS Name: N-[1-[(E)-3-(5-bromo-2-fluorophenyl)-1-oxoprop-2-enyl]-4-piperidinyl]-4-fluorobenzamide IUPAC Name: N-[1-[(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoyl]piperidin-4-yl]-4-fluorobenzamide Traditional Name: N-[1-[(E)-3-(5-bromo-2-fluoro-phenyl)acryloyl]-4-piperidyl]-4-fluoro-benzamide Formula: C21H19BrF2N2O2 MolecularWeight: 449.288566

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=C(C=C2)F)C(=O)C=CC3=C(C=CC(=C3)Br)F

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=C(C=C2)F)C(=O)/C=C/C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C21H19BrF2N2O2/c22-16-4-7-19(24)15(13-16)3-8-20(27)26-11-9-18(10-12-26)25-21(28)14-1-5-17(23)6-2-14/h1-8,13,18H,9-12H2,(H,25,28)/b8-3+