4-(5-chloranyl-2-phenethyloxy-phenyl)butanenitrile

Systemtic Name: 4-(5-chloranyl-2-phenethyloxy-phenyl)butanenitrile Openeye Name: 4-(5-chloro-2-phenethyloxy-phenyl)butanenitrile CAS Name: 4-(5-chloro-2-phenethyloxyphenyl)butanenitrile IUPAC Name: 4-(5-chloro-2-phenethyloxyphenyl)butanenitrile Traditional Name: 4-(5-chloro-2-phenethyloxy-phenyl)butyronitrile Formula: C18H18ClNO MolecularWeight: 299.79462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Cl)CCCC#N

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Cl)CCCC#N

InChI

InChI=1S/C18H18ClNO/c19-17-9-10-18(16(14-17)8-4-5-12-20)21-13-11-15-6-2-1-3-7-15/h1-3,6-7,9-10,14H,4-5,8,11,13H2