2-[2-bromanyl-4-(cyanomethyl)-5-[2-(oxan-2-yloxy)ethoxy]phenyl]ethanenitrile

Systemtic Name: 2-[2-bromanyl-4-(cyanomethyl)-5-[2-(oxan-2-yloxy)ethoxy]phenyl]ethanenitrile Openeye Name: 2-[2-bromo-4-(cyanomethyl)-5-(2-tetrahydropyran-2-yloxyethoxy)phenyl]acetonitrile CAS Name: 2-[2-bromo-4-(cyanomethyl)-5-[2-(2-oxanyloxy)ethoxy]phenyl]acetonitrile IUPAC Name: 2-[2-bromo-4-(cyanomethyl)-5-[2-(oxan-2-yloxy)ethoxy]phenyl]acetonitrile Traditional Name: 2-[2-bromo-4-(cyanomethyl)-5-(2-tetrahydropyran-2-yloxyethoxy)phenyl]acetonitrile Formula: C17H19BrN2O3 MolecularWeight: 379.24836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OCCOC2=C(C=C(C(=C2)CC#N)Br)CC#N

Isomeric SMILES

C1CCOC(C1)OCCOC2=C(C=C(C(=C2)CC#N)Br)CC#N

InChI

InChI=1S/C17H19BrN2O3/c18-15-11-14(5-7-20)16(12-13(15)4-6-19)21-9-10-23-17-3-1-2-8-22-17/h11-12,17H,1-5,8-10H2