(2S)-2-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]-N-ethyl-propanamide

Systemtic Name: (2S)-2-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]-N-ethyl-propanamide Openeye Name: (2S)-2-[[(E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoyl]amino]-N-ethyl-propanamide CAS Name: (2S)-2-[[(E)-3-(5-bromo-2-fluorophenyl)-1-oxoprop-2-enyl]amino]-N-ethylpropanamide IUPAC Name: (2S)-2-[[(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoyl]amino]-N-ethylpropanamide Traditional Name: (2S)-2-[[(E)-3-(5-bromo-2-fluoro-phenyl)acryloyl]amino]-N-ethyl-propionamide Formula: C14H16BrFN2O2 MolecularWeight: 343.191443

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)C=CC1=C(C=CC(=C1)Br)F

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)/C=C/C1=C(C=CC(=C1)Br)F

InChI

InChI=1S/C14H16BrFN2O2/c1-3-17-14(20)9(2)18-13(19)7-4-10-8-11(15)5-6-12(10)16/h4-9H,3H2,1-2H3,(H,17,20)(H,18,19)/b7-4+/t9-/m0/s1