4-chloranyl-2-(4-imidazol-1-yl-1-phenyl-butoxy)benzenecarbonitrile

Systemtic Name: 4-chloranyl-2-(4-imidazol-1-yl-1-phenyl-butoxy)benzenecarbonitrile Openeye Name: 4-chloro-2-(4-imidazol-1-yl-1-phenyl-butoxy)benzonitrile CAS Name: 4-chloro-2-[4-(1-imidazolyl)-1-phenylbutoxy]benzonitrile IUPAC Name: 4-chloro-2-(4-imidazol-1-yl-1-phenylbutoxy)benzonitrile Traditional Name: 4-chloro-2-(4-imidazol-1-yl-1-phenyl-butoxy)benzonitrile Formula: C20H18ClN3O MolecularWeight: 351.82942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCCN2C=CN=C2)OC3=C(C=CC(=C3)Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(CCCN2C=CN=C2)OC3=C(C=CC(=C3)Cl)C#N

InChI

InChI=1S/C20H18ClN3O/c21-18-9-8-17(14-22)20(13-18)25-19(16-5-2-1-3-6-16)7-4-11-24-12-10-23-15-24/h1-3,5-6,8-10,12-13,15,19H,4,7,11H2