2-(2-bromanyl-4-fluoranyl-phenoxy)-1-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(2-bromanyl-4-fluoranyl-phenoxy)-1-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]ethanone Openeye Name: 2-(2-bromo-4-fluoro-phenoxy)-1-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 2-(2-bromo-4-fluorophenoxy)-1-[4-[(5-nitro-2-thiophenyl)-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 2-(2-bromo-4-fluorophenoxy)-1-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-(2-bromo-4-fluoro-phenoxy)-1-[4-(5-nitrothiophene-2-carbonyl)piperazino]ethanone Formula: C17H15BrFN3O5S MolecularWeight: 472.285503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=C(C=C(C=C2)F)Br)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)COC2=C(C=C(C=C2)F)Br)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H15BrFN3O5S/c18-12-9-11(19)1-2-13(12)27-10-15(23)20-5-7-21(8-6-20)17(24)14-3-4-16(28-14)22(25)26/h1-4,9H,5-8,10H2