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

Systemtic Name: propyl 3-(6-bromanyl-1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoate Openeye Name: propyl 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 propyl ester IUPAC Name: propyl 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 propyl ester Formula: C14H12BrNO4 MolecularWeight: 338.15338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12BrNO4/c1-2-3-18-14(17)10(7-16)4-9-5-12-13(6-11(9)15)20-8-19-12/h4-6H,2-3,8H2,1H3