6-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]hexanoic acid

Systemtic Name: 6-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]hexanoic acid Openeye Name: 6-[[(E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoyl]amino]hexanoic acid CAS Name: 6-[[(E)-3-(5-bromo-2-fluorophenyl)-1-oxoprop-2-enyl]amino]hexanoic acid IUPAC Name: 6-[[(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoyl]amino]hexanoic acid Traditional Name: 6-[[(E)-3-(5-bromo-2-fluoro-phenyl)acryloyl]amino]hexanoic acid Formula: C15H17BrFNO3 MolecularWeight: 358.202783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C=CC(=O)NCCCCCC(=O)O)F

Isomeric SMILES

C1=CC(=C(C=C1Br)/C=C/C(=O)NCCCCCC(=O)O)F

InChI

InChI=1S/C15H17BrFNO3/c16-12-6-7-13(17)11(10-12)5-8-14(19)18-9-3-1-2-4-15(20)21/h5-8,10H,1-4,9H2,(H,18,19)(H,20,21)/b8-5+