2-[4,5-bis(chloranyl)benzotriazol-1-yl]ethanenitrile

Systemtic Name: 2-[4,5-bis(chloranyl)benzotriazol-1-yl]ethanenitrile Openeye Name: 2-(4,5-dichlorobenzotriazol-1-yl)acetonitrile CAS Name: 2-(4,5-dichloro-1-benzotriazolyl)acetonitrile IUPAC Name: 2-(4,5-dichlorobenzotriazol-1-yl)acetonitrile Traditional Name: 2-(4,5-dichlorobenzotriazol-1-yl)acetonitrile Formula: C8H4Cl2N4 MolecularWeight: 227.05016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C2=C1N(N=N2)CC#N)Cl)Cl

Isomeric SMILES

C1=CC(=C(C2=C1N(N=N2)CC#N)Cl)Cl

InChI

InChI=1S/C8H4Cl2N4/c9-5-1-2-6-8(7(5)10)12-13-14(6)4-3-11/h1-2H,4H2