[2-[[2,6-bis(bromanyl)-4-nitro-phenyl]amino]-2-oxidanylidene-ethyl] butanoate

Systemtic Name: [2-[[2,6-bis(bromanyl)-4-nitro-phenyl]amino]-2-oxidanylidene-ethyl] butanoate Openeye Name: [2-(2,6-dibromo-4-nitro-anilino)-2-oxo-ethyl] butanoate CAS Name: butanoic acid [2-(2,6-dibromo-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dibromo-4-nitroanilino)-2-oxoethyl] butanoate Traditional Name: butyric acid [2-(2,6-dibromo-4-nitro-anilino)-2-keto-ethyl] ester Formula: C12H12Br2N2O5 MolecularWeight: 424.04208

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(=O)NC1=C(C=C(C=C1Br)[N+](=O)[O-])Br

Isomeric SMILES

CCCC(=O)OCC(=O)NC1=C(C=C(C=C1Br)[N+](=O)[O-])Br

InChI

InChI=1S/C12H12Br2N2O5/c1-2-3-11(18)21-6-10(17)15-12-8(13)4-7(16(19)20)5-9(12)14/h4-5H,2-3,6H2,1H3,(H,15,17)