ethyl (E)-2-(4-bromanyl-2-fluoranyl-3-methyl-phenyl)carbonyl-3-(cyclopropylamino)prop-2-enoate

Systemtic Name: ethyl (E)-2-(4-bromanyl-2-fluoranyl-3-methyl-phenyl)carbonyl-3-(cyclopropylamino)prop-2-enoate Openeye Name: ethyl (E)-2-(4-bromo-2-fluoro-3-methyl-benzoyl)-3-(cyclopropylamino)prop-2-enoate CAS Name: (E)-2-[(4-bromo-2-fluoro-3-methylphenyl)-oxomethyl]-3-(cyclopropylamino)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-(4-bromo-2-fluoro-3-methylbenzoyl)-3-(cyclopropylamino)prop-2-enoate Traditional Name: (E)-2-(4-bromo-2-fluoro-3-methyl-benzoyl)-3-(cyclopropylamino)acrylic acid ethyl ester Formula: C16H17BrFNO3 MolecularWeight: 370.213483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1CC1)C(=O)C2=C(C(=C(C=C2)Br)C)F

Isomeric SMILES

CCOC(=O)/C(=C/NC1CC1)/C(=O)C2=C(C(=C(C=C2)Br)C)F

InChI

InChI=1S/C16H17BrFNO3/c1-3-22-16(21)12(8-19-10-4-5-10)15(20)11-6-7-13(17)9(2)14(11)18/h6-8,10,19H,3-5H2,1-2H3/b12-8+