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

Systemtic Name: 2-chloranyl-4,6-bis(2-methylpropyl)-3-nitro-benzenecarbonitrile Openeye Name: 2-chloro-4,6-diisobutyl-3-nitro-benzonitrile CAS Name: 2-chloro-4,6-bis(2-methylpropyl)-3-nitrobenzonitrile IUPAC Name: 2-chloro-4,6-bis(2-methylpropyl)-3-nitrobenzonitrile Traditional Name: 2-chloro-4,6-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)Cl)[N+](=O)[O-])CC(C)C

Isomeric SMILES

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

InChI

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