methyl 4-[2-[2-[2-(4-bromophenyl)-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]sulfanylethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[2-[2-(4-bromophenyl)-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]sulfanylethanoylamino]benzoate Openeye Name: methyl 4-[[2-[2-[2-(4-bromophenyl)-2-oxo-ethoxy]-2-oxo-ethyl]sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[[2-[2-(4-bromophenyl)-2-oxoethoxy]-2-oxoethyl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[2-[2-(4-bromophenyl)-2-oxoethoxy]-2-oxoethyl]sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[[2-[2-(4-bromophenyl)-2-keto-ethoxy]-2-keto-ethyl]thio]acetyl]amino]benzoic acid methyl ester Formula: C20H18BrNO6S MolecularWeight: 480.32902

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CSCC(=O)OCC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CSCC(=O)OCC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C20H18BrNO6S/c1-27-20(26)14-4-8-16(9-5-14)22-18(24)11-29-12-19(25)28-10-17(23)13-2-6-15(21)7-3-13/h2-9H,10-12H2,1H3,(H,22,24)