[2-[[2,6-bis(bromanyl)-4-nitro-phenyl]amino]-2-oxidanylidene-ethyl] 3,3-dimethylbutanoate

Systemtic Name: [2-[[2,6-bis(bromanyl)-4-nitro-phenyl]amino]-2-oxidanylidene-ethyl] 3,3-dimethylbutanoate Openeye Name: [2-(2,6-dibromo-4-nitro-anilino)-2-oxo-ethyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [2-(2,6-dibromo-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dibromo-4-nitroanilino)-2-oxoethyl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [2-(2,6-dibromo-4-nitro-anilino)-2-keto-ethyl] ester Formula: C14H16Br2N2O5 MolecularWeight: 452.09524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16Br2N2O5/c1-14(2,3)6-12(20)23-7-11(19)17-13-9(15)4-8(18(21)22)5-10(13)16/h4-5H,6-7H2,1-3H3,(H,17,19)