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

Systemtic Name: ethyl 2-[2-[[2,6-bis(bromanyl)-4-nitro-phenyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C12H12Br2N2O5S MolecularWeight: 456.10708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12Br2N2O5S/c1-2-21-11(18)6-22-5-10(17)15-12-8(13)3-7(16(19)20)4-9(12)14/h3-4H,2,5-6H2,1H3,(H,15,17)