(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) (E)-3-(5-bromanylfuran-2-yl)prop-2-enoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) (E)-3-(5-bromanylfuran-2-yl)prop-2-enoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) (E)-3-(5-bromo-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-furanyl)-2-propenoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) (E)-3-(5-bromofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-furyl)acrylic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C13H11BrN2O4 MolecularWeight: 339.14144

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C=CC1=CC=C(O1)Br

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)/C=C/C1=CC=C(O1)Br

InChI

InChI=1S/C13H11BrN2O4/c1-8(16)10(6-15)11(17)7-19-13(18)5-3-9-2-4-12(14)20-9/h2-5,10,16H,7H2,1H3/b5-3+,16-8?