2-chloranyl-4-(cyanomethyl)-3,6-diethyl-benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-(cyanomethyl)-3,6-diethyl-benzenecarbonitrile Openeye Name: 2-chloro-4-(cyanomethyl)-3,6-diethyl-benzonitrile CAS Name: 2-chloro-4-(cyanomethyl)-3,6-diethylbenzonitrile IUPAC Name: 2-chloro-4-(cyanomethyl)-3,6-diethylbenzonitrile Traditional Name: 2-chloro-4-(cyanomethyl)-3,6-diethyl-benzonitrile Formula: C13H13ClN2 MolecularWeight: 232.70872

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1C#N)Cl)CC)CC#N

Isomeric SMILES

CCC1=CC(=C(C(=C1C#N)Cl)CC)CC#N

InChI

InChI=1S/C13H13ClN2/c1-3-9-7-10(5-6-15)11(4-2)13(14)12(9)8-16/h7H,3-5H2,1-2H3