4-(2-bromoethyl)-2-butyl-1-nitro-benzene

Systemtic Name: 4-(2-bromoethyl)-2-butyl-1-nitro-benzene Openeye Name: 4-(2-bromoethyl)-2-butyl-1-nitro-benzene CAS Name: 4-(2-bromoethyl)-2-butyl-1-nitrobenzene IUPAC Name: 4-(2-bromoethyl)-2-butyl-1-nitrobenzene Traditional Name: 4-(2-bromoethyl)-2-butyl-1-nitro-benzene Formula: C12H16BrNO2 MolecularWeight: 286.16494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16BrNO2/c1-2-3-4-11-9-10(7-8-13)5-6-12(11)14(15)16/h5-6,9H,2-4,7-8H2,1H3