3-bromanyl-5-ethoxy-4-hexoxy-benzenecarbonitrile

Systemtic Name: 3-bromanyl-5-ethoxy-4-hexoxy-benzenecarbonitrile Openeye Name: 3-bromo-5-ethoxy-4-hexoxy-benzonitrile CAS Name: 3-bromo-5-ethoxy-4-hexoxybenzonitrile IUPAC Name: 3-bromo-5-ethoxy-4-hexoxybenzonitrile Traditional Name: 3-bromo-5-ethoxy-4-hexoxy-benzonitrile Formula: C15H20BrNO2 MolecularWeight: 326.2288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1Br)C#N)OCC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1Br)C#N)OCC

InChI

InChI=1S/C15H20BrNO2/c1-3-5-6-7-8-19-15-13(16)9-12(11-17)10-14(15)18-4-2/h9-10H,3-8H2,1-2H3