4-chloranyl-2-(4-iodanyl-1-phenyl-butoxy)benzenecarbonitrile

Systemtic Name: 4-chloranyl-2-(4-iodanyl-1-phenyl-butoxy)benzenecarbonitrile Openeye Name: 4-chloro-2-(4-iodo-1-phenyl-butoxy)benzonitrile CAS Name: 4-chloro-2-(4-iodo-1-phenylbutoxy)benzonitrile IUPAC Name: 4-chloro-2-(4-iodo-1-phenylbutoxy)benzonitrile Traditional Name: 4-chloro-2-(4-iodo-1-phenyl-butoxy)benzonitrile Formula: C17H15ClINO MolecularWeight: 411.66457

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCCI)OC2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(CCCI)OC2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C17H15ClINO/c18-15-9-8-14(12-20)17(11-15)21-16(7-4-10-19)13-5-2-1-3-6-13/h1-3,5-6,8-9,11,16H,4,7,10H2