4-(4-chloranyl-3,5-dimethyl-phenoxy)-5-nitro-benzene-1,2-dicarbonitrile

Systemtic Name: 4-(4-chloranyl-3,5-dimethyl-phenoxy)-5-nitro-benzene-1,2-dicarbonitrile Openeye Name: 4-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-phthalonitrile CAS Name: 4-(4-chloro-3,5-dimethylphenoxy)-5-nitrobenzene-1,2-dicarbonitrile IUPAC Name: 4-(4-chloro-3,5-dimethylphenoxy)-5-nitrobenzene-1,2-dicarbonitrile Traditional Name: 4-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-phthalonitrile Formula: C16H10ClN3O3 MolecularWeight: 327.7219

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=C(C=C(C(=C2)C#N)C#N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=C(C=C(C(=C2)C#N)C#N)[N+](=O)[O-]

InChI

InChI=1S/C16H10ClN3O3/c1-9-3-13(4-10(2)16(9)17)23-15-6-12(8-19)11(7-18)5-14(15)20(21)22/h3-6H,1-2H3