3-bromanyl-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzenecarbonitrile

Systemtic Name: 3-bromanyl-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzenecarbonitrile Openeye Name: 3-bromo-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzonitrile CAS Name: 3-bromo-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzonitrile IUPAC Name: 3-bromo-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzonitrile Traditional Name: 3-bromo-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzonitrile Formula: C18H18BrNO2 MolecularWeight: 360.24502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCCOC2=C(C=C(C=C2)C#N)Br)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCCOC2=C(C=C(C=C2)C#N)Br)C

InChI

InChI=1S/C18H18BrNO2/c1-12-4-5-13(2)18(14(12)3)22-9-8-21-17-7-6-15(11-20)10-16(17)19/h4-7,10H,8-9H2,1-3H3