[3,5-bis(chloranyl)-2-methyl-4-nitro-phenyl]-isocyano-methanone

Systemtic Name: [3,5-bis(chloranyl)-2-methyl-4-nitro-phenyl]-isocyano-methanone Openeye Name: 3,5-dichloro-2-methyl-4-nitro-benzoyl isocyanide CAS Name: (3,5-dichloro-2-methyl-4-nitrophenyl)-isocyanomethanone IUPAC Name: 3,5-dichloro-2-methyl-4-nitrobenzoyl isocyanide Traditional Name: (3,5-dichloro-2-methyl-4-nitro-phenyl)-isocyano-methanone Formula: C9H4Cl2N2O3 MolecularWeight: 259.04566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C(=O)[N+]#[C-])Cl)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=C(C=C1C(=O)[N+]#[C-])Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C9H4Cl2N2O3/c1-4-5(9(14)12-2)3-6(10)8(7(4)11)13(15)16/h3H,1H3