(E)-3-(3-bromanyl-5-ethoxy-4-propoxy-phenyl)-2-(2-methylfuran-3-yl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-bromanyl-5-ethoxy-4-propoxy-phenyl)-2-(2-methylfuran-3-yl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3-bromo-5-ethoxy-4-propoxy-phenyl)-2-(2-methylfuran-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(3-bromo-5-ethoxy-4-propoxyphenyl)-2-[(2-methyl-3-furanyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3-bromo-5-ethoxy-4-propoxyphenyl)-2-(2-methylfuran-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(3-bromo-5-ethoxy-4-propoxy-phenyl)-2-(2-methyl-3-furoyl)acrylonitrile Formula: C20H20BrNO4 MolecularWeight: 418.2811

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C=C(C#N)C(=O)C2=C(OC=C2)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)/C=C(\C#N)/C(=O)C2=C(OC=C2)C)OCC

InChI

InChI=1S/C20H20BrNO4/c1-4-7-26-20-17(21)10-14(11-18(20)24-5-2)9-15(12-22)19(23)16-6-8-25-13(16)3/h6,8-11H,4-5,7H2,1-3H3/b15-9+