(E)-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)acrylamide Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C=C(C#N)C(=O)N

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)/C=C(\C#N)/C(=O)N

InChI

InChI=1S/C12H10N2O4/c1-16-9-3-7(2-8(5-13)12(14)15)4-10-11(9)18-6-17-10/h2-4H,6H2,1H3,(H2,14,15)/b8-2+