4-[bis(chloranyl)methyl]-1-butyl-2-nitro-benzene

Systemtic Name: 4-[bis(chloranyl)methyl]-1-butyl-2-nitro-benzene Openeye Name: 1-butyl-4-(dichloromethyl)-2-nitro-benzene CAS Name: 1-butyl-4-(dichloromethyl)-2-nitrobenzene IUPAC Name: 1-butyl-4-(dichloromethyl)-2-nitrobenzene Traditional Name: 1-butyl-4-(dichloromethyl)-2-nitro-benzene Formula: C11H13Cl2NO2 MolecularWeight: 262.13242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C=C1)C(Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=C(C=C(C=C1)C(Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C11H13Cl2NO2/c1-2-3-4-8-5-6-9(11(12)13)7-10(8)14(15)16/h5-7,11H,2-4H2,1H3