3-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]-N,N-diethyl-benzamide

Systemtic Name: 3-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]-N,N-diethyl-benzamide Openeye Name: 3-[[(E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[(E)-3-(5-bromo-2-fluorophenyl)-1-oxoprop-2-enyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[(E)-3-(5-bromo-2-fluoro-phenyl)acryloyl]amino]-N,N-diethyl-benzamide Formula: C20H20BrFN2O2 MolecularWeight: 419.287403

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C=CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)/C=C/C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C20H20BrFN2O2/c1-3-24(4-2)20(26)15-6-5-7-17(13-15)23-19(25)11-8-14-12-16(21)9-10-18(14)22/h5-13H,3-4H2,1-2H3,(H,23,25)/b11-8+