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

Systemtic Name: 2-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]-2-cyclopropyl-propanoic acid Openeye Name: 2-[[(E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoyl]amino]-2-cyclopropyl-propanoic acid CAS Name: 2-[[(E)-3-(5-bromo-2-fluorophenyl)-1-oxoprop-2-enyl]amino]-2-cyclopropylpropanoic acid IUPAC Name: 2-[[(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoyl]amino]-2-cyclopropylpropanoic acid Traditional Name: 2-[[(E)-3-(5-bromo-2-fluoro-phenyl)acryloyl]amino]-2-cyclopropyl-propionic acid Formula: C15H15BrFNO3 MolecularWeight: 356.186903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)(C(=O)O)NC(=O)C=CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CC(C1CC1)(C(=O)O)NC(=O)/C=C/C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C15H15BrFNO3/c1-15(14(20)21,10-3-4-10)18-13(19)7-2-9-8-11(16)5-6-12(9)17/h2,5-8,10H,3-4H2,1H3,(H,18,19)(H,20,21)/b7-2+