methyl 3-(6-bromanyl-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoate

Systemtic Name: methyl 3-(6-bromanyl-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoate Openeye Name: methyl 3-(6-bromo-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoate CAS Name: 3-(6-bromo-1,3-benzodioxol-5-yl)-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl 3-(6-bromo-1,3-benzodioxol-5-yl)-2-cyanoprop-2-enoate Traditional Name: 3-(6-bromo-1,3-benzodioxol-5-yl)-2-cyano-acrylic acid methyl ester Formula: C12H8BrNO4 MolecularWeight: 310.10022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8BrNO4/c1-16-12(15)8(5-14)2-7-3-10-11(4-9(7)13)18-6-17-10/h2-4H,6H2,1H3