2-(3-bromanyl-4-methoxy-5-prop-2-enoxy-phenyl)ethanenitrile

Systemtic Name: 2-(3-bromanyl-4-methoxy-5-prop-2-enoxy-phenyl)ethanenitrile Openeye Name: 2-(3-allyloxy-5-bromo-4-methoxy-phenyl)acetonitrile CAS Name: 2-(3-bromo-4-methoxy-5-prop-2-enoxyphenyl)acetonitrile IUPAC Name: 2-(3-bromo-4-methoxy-5-prop-2-enoxyphenyl)acetonitrile Traditional Name: 2-(3-allyloxy-5-bromo-4-methoxy-phenyl)acetonitrile Formula: C12H12BrNO2 MolecularWeight: 282.13318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Br)CC#N)OCC=C

Isomeric SMILES

COC1=C(C=C(C=C1Br)CC#N)OCC=C

InChI

InChI=1S/C12H12BrNO2/c1-3-6-16-11-8-9(4-5-14)7-10(13)12(11)15-2/h3,7-8H,1,4,6H2,2H3