3-chloranyl-4-(cyanomethyl)-2-propan-2-yl-benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-(cyanomethyl)-2-propan-2-yl-benzenecarbonitrile Openeye Name: 3-chloro-4-(cyanomethyl)-2-isopropyl-benzonitrile CAS Name: 3-chloro-4-(cyanomethyl)-2-propan-2-ylbenzonitrile IUPAC Name: 3-chloro-4-(cyanomethyl)-2-propan-2-ylbenzonitrile Traditional Name: 3-chloro-4-(cyanomethyl)-2-isopropyl-benzonitrile Formula: C12H11ClN2 MolecularWeight: 218.68214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1Cl)CC#N)C#N

Isomeric SMILES

CC(C)C1=C(C=CC(=C1Cl)CC#N)C#N

InChI

InChI=1S/C12H11ClN2/c1-8(2)11-10(7-15)4-3-9(5-6-14)12(11)13/h3-4,8H,5H2,1-2H3