3-chloranyl-4-(cyanomethyl)-5-ethyl-benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-(cyanomethyl)-5-ethyl-benzenecarbonitrile Openeye Name: 3-chloro-4-(cyanomethyl)-5-ethyl-benzonitrile CAS Name: 3-chloro-4-(cyanomethyl)-5-ethylbenzonitrile IUPAC Name: 3-chloro-4-(cyanomethyl)-5-ethylbenzonitrile Traditional Name: 3-chloro-4-(cyanomethyl)-5-ethyl-benzonitrile Formula: C11H9ClN2 MolecularWeight: 204.65556

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)C#N)Cl)CC#N

Isomeric SMILES

CCC1=C(C(=CC(=C1)C#N)Cl)CC#N

InChI

InChI=1S/C11H9ClN2/c1-2-9-5-8(7-14)6-11(12)10(9)3-4-13/h5-6H,2-3H2,1H3