(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) (E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-2-propenoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)acrylic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C15H12BrFN2O3 MolecularWeight: 367.169783

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C=CC1=C(C=CC(=C1)Br)F

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)/C=C/C1=C(C=CC(=C1)Br)F

InChI

InChI=1S/C15H12BrFN2O3/c1-9(19)12(7-18)14(20)8-22-15(21)5-2-10-6-11(16)3-4-13(10)17/h2-6,12,19H,8H2,1H3/b5-2+,19-9?