(E)-3-[3,5-bis(bromanyl)-2-methoxy-phenyl]-2-cyano-prop-2-enoic acid

Systemtic Name: (E)-3-[3,5-bis(bromanyl)-2-methoxy-phenyl]-2-cyano-prop-2-enoic acid Openeye Name: (E)-2-cyano-3-(3,5-dibromo-2-methoxy-phenyl)prop-2-enoic acid CAS Name: (E)-2-cyano-3-(3,5-dibromo-2-methoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(3,5-dibromo-2-methoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-cyano-3-(3,5-dibromo-2-methoxy-phenyl)acrylic acid Formula: C11H7Br2NO3 MolecularWeight: 360.98618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C=C(C#N)C(=O)O)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1/C=C(\C#N)/C(=O)O)Br)Br

InChI

InChI=1S/C11H7Br2NO3/c1-17-10-6(2-7(5-14)11(15)16)3-8(12)4-9(10)13/h2-4H,1H3,(H,15,16)/b7-2+