2-(4-bromanyl-2,5-dihexoxy-phenyl)ethanenitrile

Systemtic Name: 2-(4-bromanyl-2,5-dihexoxy-phenyl)ethanenitrile Openeye Name: 2-(4-bromo-2,5-dihexoxy-phenyl)acetonitrile CAS Name: 2-(4-bromo-2,5-dihexoxyphenyl)acetonitrile IUPAC Name: 2-(4-bromo-2,5-dihexoxyphenyl)acetonitrile Traditional Name: 2-(4-bromo-2,5-dihexoxy-phenyl)acetonitrile Formula: C20H30BrNO2 MolecularWeight: 396.3617

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=C(C=C1CC#N)OCCCCCC)Br

Isomeric SMILES

CCCCCCOC1=CC(=C(C=C1CC#N)OCCCCCC)Br

InChI

InChI=1S/C20H30BrNO2/c1-3-5-7-9-13-23-19-16-18(21)20(15-17(19)11-12-22)24-14-10-8-6-4-2/h15-16H,3-11,13-14H2,1-2H3