methyl 2-[2,6-bis(chloranyl)-4-nitro-phenyl]-2-isocyano-ethanoate

Systemtic Name: methyl 2-[2,6-bis(chloranyl)-4-nitro-phenyl]-2-isocyano-ethanoate Openeye Name: methyl 2-(2,6-dichloro-4-nitro-phenyl)-2-isocyano-acetate CAS Name: 2-(2,6-dichloro-4-nitrophenyl)-2-isocyanoacetic acid methyl ester IUPAC Name: methyl 2-(2,6-dichloro-4-nitrophenyl)-2-isocyanoacetate Traditional Name: 2-(2,6-dichloro-4-nitro-phenyl)-2-isocyano-acetic acid methyl ester Formula: C10H6Cl2N2O4 MolecularWeight: 289.07164

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=C(C=C(C=C1Cl)[N+](=O)[O-])Cl)[N+]#[C-]

Isomeric SMILES

COC(=O)C(C1=C(C=C(C=C1Cl)[N+](=O)[O-])Cl)[N+]#[C-]

InChI

InChI=1S/C10H6Cl2N2O4/c1-13-9(10(15)18-2)8-6(11)3-5(14(16)17)4-7(8)12/h3-4,9H,2H3