4-chloranyl-3-nitro-2,6-di(propan-2-yl)benzenecarbonitrile

Systemtic Name: 4-chloranyl-3-nitro-2,6-di(propan-2-yl)benzenecarbonitrile Openeye Name: 4-chloro-2,6-diisopropyl-3-nitro-benzonitrile CAS Name: 4-chloro-3-nitro-2,6-di(propan-2-yl)benzonitrile IUPAC Name: 4-chloro-3-nitro-2,6-di(propan-2-yl)benzonitrile Traditional Name: 4-chloro-2,6-diisopropyl-3-nitro-benzonitrile Formula: C13H15ClN2O2 MolecularWeight: 266.7234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1C#N)C(C)C)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1C#N)C(C)C)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H15ClN2O2/c1-7(2)9-5-11(14)13(16(17)18)12(8(3)4)10(9)6-15/h5,7-8H,1-4H3