butyl (E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoate

Systemtic Name: butyl (E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoate Openeye Name: butyl (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-2-propenoic acid butyl ester IUPAC Name: butyl (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-cyano-acrylic acid butyl ester Formula: C15H14BrNO4 MolecularWeight: 352.17996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=CC1=CC2=C(C(=C1)Br)OCO2)C#N

Isomeric SMILES

CCCCOC(=O)/C(=C/C1=CC2=C(C(=C1)Br)OCO2)/C#N

InChI

InChI=1S/C15H14BrNO4/c1-2-3-4-19-15(18)11(8-17)5-10-6-12(16)14-13(7-10)20-9-21-14/h5-7H,2-4,9H2,1H3/b11-5+