2,6-ditert-butyl-4-chloranyl-3-(cyanomethyl)benzenecarbonitrile

Systemtic Name: 2,6-ditert-butyl-4-chloranyl-3-(cyanomethyl)benzenecarbonitrile Openeye Name: 2,6-ditert-butyl-4-chloro-3-(cyanomethyl)benzonitrile CAS Name: 2,6-ditert-butyl-4-chloro-3-(cyanomethyl)benzonitrile IUPAC Name: 2,6-ditert-butyl-4-chloro-3-(cyanomethyl)benzonitrile Traditional Name: 2,6-ditert-butyl-4-chloro-3-(cyanomethyl)benzonitrile Formula: C17H21ClN2 MolecularWeight: 288.81504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1C#N)C(C)(C)C)CC#N)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1C#N)C(C)(C)C)CC#N)Cl

InChI

InChI=1S/C17H21ClN2/c1-16(2,3)13-9-14(18)11(7-8-19)15(12(13)10-20)17(4,5)6/h9H,7H2,1-6H3