4-chloranyl-5-methyl-benzene-1,2-dicarbonitrile

Systemtic Name: 4-chloranyl-5-methyl-benzene-1,2-dicarbonitrile Openeye Name: 4-chloro-5-methyl-phthalonitrile CAS Name: 4-chloro-5-methylbenzene-1,2-dicarbonitrile IUPAC Name: 4-chloro-5-methylbenzene-1,2-dicarbonitrile Traditional Name: 4-chloro-5-methyl-phthalonitrile Formula: C9H5ClN2 MolecularWeight: 176.6024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C#N)C#N)Cl

Isomeric SMILES

CC1=C(C=C(C(=C1)C#N)C#N)Cl

InChI

InChI=1S/C9H5ClN2/c1-6-2-7(4-11)8(5-12)3-9(6)10/h2-3H,1H3