methyl 2-[6,6-bis(fluoranyl)hex-5-enoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[6,6-bis(fluoranyl)hex-5-enoylamino]-3-phenyl-propanoate Openeye Name: methyl 2-(6,6-difluorohex-5-enoylamino)-3-phenyl-propanoate CAS Name: 2-[(6,6-difluoro-1-oxohex-5-enyl)amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-(6,6-difluorohex-5-enoylamino)-3-phenylpropanoate Traditional Name: 2-(6,6-difluorohex-5-enoylamino)-3-phenyl-propionic acid methyl ester Formula: C16H19F2NO3 MolecularWeight: 311.323766

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)CCCC=C(F)F

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)CCCC=C(F)F

InChI

InChI=1S/C16H19F2NO3/c1-22-16(21)13(11-12-7-3-2-4-8-12)19-15(20)10-6-5-9-14(17)18/h2-4,7-9,13H,5-6,10-11H2,1H3,(H,19,20)