O3-[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(5-bromo-2-thienyl)-2-oxo-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 3-O-[2-(5-bromothiophen-2-yl)-2-oxoethyl] 1-O-ethyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(5-bromo-2-thienyl)-2-keto-ethyl] ester O1-ethyl ester Formula: C16H12BrNO7S MolecularWeight: 442.23798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)C2=CC=C(S2)Br)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)C2=CC=C(S2)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H12BrNO7S/c1-2-24-15(20)9-5-10(7-11(6-9)18(22)23)16(21)25-8-12(19)13-3-4-14(17)26-13/h3-7H,2,8H2,1H3