(E)-3-(6-bromanyl-1,3-benzodioxol-5-yl)-2-cyano-N-prop-2-enyl-prop-2-enamide

Systemtic Name: (E)-3-(6-bromanyl-1,3-benzodioxol-5-yl)-2-cyano-N-prop-2-enyl-prop-2-enamide Openeye Name: (E)-N-allyl-3-(6-bromo-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enamide CAS Name: (E)-3-(6-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-prop-2-enyl-2-propenamide IUPAC Name: (E)-3-(6-bromo-1,3-benzodioxol-5-yl)-2-cyano-N-prop-2-enylprop-2-enamide Traditional Name: (E)-N-allyl-3-(6-bromo-1,3-benzodioxol-5-yl)-2-cyano-acrylamide Formula: C14H11BrN2O3 MolecularWeight: 335.15274

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C(=CC1=CC2=C(C=C1Br)OCO2)C#N

Isomeric SMILES

C=CCNC(=O)/C(=C/C1=CC2=C(C=C1Br)OCO2)/C#N

InChI

InChI=1S/C14H11BrN2O3/c1-2-3-17-14(18)10(7-16)4-9-5-12-13(6-11(9)15)20-8-19-12/h2,4-6H,1,3,8H2,(H,17,18)/b10-4+