4-chloranyl-2,6-bis(2-methylpropyl)-3-nitro-benzenecarbonitrile

Systemtic Name: 4-chloranyl-2,6-bis(2-methylpropyl)-3-nitro-benzenecarbonitrile Openeye Name: 4-chloro-2,6-diisobutyl-3-nitro-benzonitrile CAS Name: 4-chloro-2,6-bis(2-methylpropyl)-3-nitrobenzonitrile IUPAC Name: 4-chloro-2,6-bis(2-methylpropyl)-3-nitrobenzonitrile Traditional Name: 4-chloro-2,6-diisobutyl-3-nitro-benzonitrile Formula: C15H19ClN2O2 MolecularWeight: 294.77656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=C(C(=C1C#N)CC(C)C)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)CC1=CC(=C(C(=C1C#N)CC(C)C)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H19ClN2O2/c1-9(2)5-11-7-14(16)15(18(19)20)12(6-10(3)4)13(11)8-17/h7,9-10H,5-6H2,1-4H3