4-(4-bromanyl-2-ethyl-5-phenylmethoxy-phenoxy)butanenitrile

Systemtic Name: 4-(4-bromanyl-2-ethyl-5-phenylmethoxy-phenoxy)butanenitrile Openeye Name: 4-(5-benzyloxy-4-bromo-2-ethyl-phenoxy)butanenitrile CAS Name: 4-(4-bromo-2-ethyl-5-phenylmethoxyphenoxy)butanenitrile IUPAC Name: 4-(4-bromo-2-ethyl-5-phenylmethoxyphenoxy)butanenitrile Traditional Name: 4-(5-benzoxy-4-bromo-2-ethyl-phenoxy)butyronitrile Formula: C19H20BrNO2 MolecularWeight: 374.2716

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1OCCCC#N)OCC2=CC=CC=C2)Br

Isomeric SMILES

CCC1=CC(=C(C=C1OCCCC#N)OCC2=CC=CC=C2)Br

InChI

InChI=1S/C19H20BrNO2/c1-2-16-12-17(20)19(13-18(16)22-11-7-6-10-21)23-14-15-8-4-3-5-9-15/h3-5,8-9,12-13H,2,6-7,11,14H2,1H3