(E)-3-(3-bromanyl-5-methoxy-4-propoxy-phenyl)-2-(phenylcarbonyl)prop-2-enenitrile

Systemtic Name: (E)-3-(3-bromanyl-5-methoxy-4-propoxy-phenyl)-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-(3-bromo-5-methoxy-4-propoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-(3-bromo-5-methoxy-4-propoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-(3-bromo-5-methoxy-4-propoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-(3-bromo-5-methoxy-4-propoxy-phenyl)acrylonitrile Formula: C20H18BrNO3 MolecularWeight: 400.26582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18BrNO3/c1-3-9-25-20-17(21)11-14(12-18(20)24-2)10-16(13-22)19(23)15-7-5-4-6-8-15/h4-8,10-12H,3,9H2,1-2H3/b16-10+