1-(bromomethyl)-2-isocyano-4-nitro-benzene

Systemtic Name: 1-(bromomethyl)-2-isocyano-4-nitro-benzene Openeye Name: 1-(bromomethyl)-2-isocyano-4-nitro-benzene CAS Name: 1-(bromomethyl)-2-isocyano-4-nitrobenzene IUPAC Name: 1-(bromomethyl)-2-isocyano-4-nitrobenzene Traditional Name: 1-(bromomethyl)-2-isocyano-4-nitro-benzene Formula: C8H5BrN2O2 MolecularWeight: 241.0415

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H5BrN2O2/c1-10-8-4-7(11(12)13)3-2-6(8)5-9/h2-4H,5H2