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

Systemtic Name: methyl 2-[2-[[2,6-bis(bromanyl)-4-nitro-phenyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: methyl 2-[2-(2,6-dibromo-4-nitro-anilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(2,6-dibromo-4-nitroanilino)-2-oxoethyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[2-(2,6-dibromo-4-nitroanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(2,6-dibromo-4-nitro-anilino)-2-keto-ethyl]thio]acetic acid methyl ester Formula: C11H10Br2N2O5S MolecularWeight: 442.0805

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCC(=O)NC1=C(C=C(C=C1Br)[N+](=O)[O-])Br

Isomeric SMILES

COC(=O)CSCC(=O)NC1=C(C=C(C=C1Br)[N+](=O)[O-])Br

InChI

InChI=1S/C11H10Br2N2O5S/c1-20-10(17)5-21-4-9(16)14-11-7(12)2-6(15(18)19)3-8(11)13/h2-3H,4-5H2,1H3,(H,14,16)