3-bromanyl-4-[2-(2,3,5-trimethylphenoxy)ethoxy]benzenecarbonitrile

Systemtic Name: 3-bromanyl-4-[2-(2,3,5-trimethylphenoxy)ethoxy]benzenecarbonitrile Openeye Name: 3-bromo-4-[2-(2,3,5-trimethylphenoxy)ethoxy]benzonitrile CAS Name: 3-bromo-4-[2-(2,3,5-trimethylphenoxy)ethoxy]benzonitrile IUPAC Name: 3-bromo-4-[2-(2,3,5-trimethylphenoxy)ethoxy]benzonitrile Traditional Name: 3-bromo-4-[2-(2,3,5-trimethylphenoxy)ethoxy]benzonitrile Formula: C18H18BrNO2 MolecularWeight: 360.24502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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