5-(bromomethyl)-1,3-dimethyl-2-nitro-benzene

Systemtic Name: 5-(bromomethyl)-1,3-dimethyl-2-nitro-benzene Openeye Name: 5-(bromomethyl)-1,3-dimethyl-2-nitro-benzene CAS Name: 5-(bromomethyl)-1,3-dimethyl-2-nitrobenzene IUPAC Name: 5-(bromomethyl)-1,3-dimethyl-2-nitrobenzene Traditional Name: 5-(bromomethyl)-1,3-dimethyl-2-nitro-benzene Formula: C9H10BrNO2 MolecularWeight: 244.0852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1[N+](=O)[O-])C)CBr

Isomeric SMILES

CC1=CC(=CC(=C1[N+](=O)[O-])C)CBr

InChI

InChI=1S/C9H10BrNO2/c1-6-3-8(5-10)4-7(2)9(6)11(12)13/h3-4H,5H2,1-2H3