2-(4-bromophenyl)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enenitrile

Systemtic Name: 2-(4-bromophenyl)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enenitrile Openeye Name: 2-(4-bromophenyl)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enenitrile CAS Name: 2-(4-bromophenyl)-3-(4-hexoxy-3-methoxyphenyl)-2-propenenitrile IUPAC Name: 2-(4-bromophenyl)-3-(4-hexoxy-3-methoxyphenyl)prop-2-enenitrile Traditional Name: 2-(4-bromophenyl)-3-(4-hexoxy-3-methoxy-phenyl)acrylonitrile Formula: C22H24BrNO2 MolecularWeight: 414.33546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=C(C#N)C2=CC=C(C=C2)Br)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C=C(C#N)C2=CC=C(C=C2)Br)OC

InChI

InChI=1S/C22H24BrNO2/c1-3-4-5-6-13-26-21-12-7-17(15-22(21)25-2)14-19(16-24)18-8-10-20(23)11-9-18/h7-12,14-15H,3-6,13H2,1-2H3