1-[5-(5-bromanyl-2-ethoxy-phenyl)-2-(5-nitrothiophen-2-yl)-2H-1,3,4-oxadiazol-3-yl]ethanone

Systemtic Name: 1-[5-(5-bromanyl-2-ethoxy-phenyl)-2-(5-nitrothiophen-2-yl)-2H-1,3,4-oxadiazol-3-yl]ethanone Openeye Name: 1-[5-(5-bromo-2-ethoxy-phenyl)-2-(5-nitro-2-thienyl)-2H-1,3,4-oxadiazol-3-yl]ethanone CAS Name: 1-[5-(5-bromo-2-ethoxyphenyl)-2-(5-nitro-2-thiophenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone IUPAC Name: 1-[5-(5-bromo-2-ethoxyphenyl)-2-(5-nitrothiophen-2-yl)-2H-1,3,4-oxadiazol-3-yl]ethanone Traditional Name: 1-[5-(5-bromo-2-ethoxy-phenyl)-2-(5-nitro-2-thienyl)-2H-1,3,4-oxadiazol-3-yl]ethanone Formula: C16H14BrN3O5S MolecularWeight: 440.26846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C2=NN(C(O2)C3=CC=C(S3)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C2=NN(C(O2)C3=CC=C(S3)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C16H14BrN3O5S/c1-3-24-12-5-4-10(17)8-11(12)15-18-19(9(2)21)16(25-15)13-6-7-14(26-13)20(22)23/h4-8,16H,3H2,1-2H3