methyl 4-[2-[(5-bromanylthiophen-2-yl)carbonylamino]oxyethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(5-bromanylthiophen-2-yl)carbonylamino]oxyethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(5-bromothiophene-2-carbonyl)amino]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[[(5-bromo-2-thiophenyl)-oxomethyl]amino]oxy-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(5-bromothiophene-2-carbonyl)amino]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[(5-bromothiophene-2-carbonyl)amino]oxyacetyl]amino]benzoic acid methyl ester Formula: C15H13BrN2O5S MolecularWeight: 413.24312

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CONC(=O)C2=CC=C(S2)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CONC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C15H13BrN2O5S/c1-22-15(21)9-2-4-10(5-3-9)17-13(19)8-23-18-14(20)11-6-7-12(16)24-11/h2-7H,8H2,1H3,(H,17,19)(H,18,20)