4-bromanyl-2,6-di(butan-2-yl)-3-nitro-benzenecarbonitrile

Systemtic Name: 4-bromanyl-2,6-di(butan-2-yl)-3-nitro-benzenecarbonitrile Openeye Name: 4-bromo-3-nitro-2,6-disec-butyl-benzonitrile CAS Name: 4-bromo-2,6-di(butan-2-yl)-3-nitrobenzonitrile IUPAC Name: 4-bromo-2,6-di(butan-2-yl)-3-nitrobenzonitrile Traditional Name: 4-bromo-3-nitro-2,6-disec-butyl-benzonitrile Formula: C15H19BrN2O2 MolecularWeight: 339.22756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19BrN2O2/c1-5-9(3)11-7-13(16)15(18(19)20)14(10(4)6-2)12(11)8-17/h7,9-10H,5-6H2,1-4H3