1-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 1-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]propan-1-one Openeye Name: 1-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]propan-1-one CAS Name: 1-[4-[(5-nitro-2-thiophenyl)-oxomethyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]propan-1-one Traditional Name: 1-[4-(5-nitrothiophene-2-carbonyl)piperazino]propan-1-one Formula: C12H15N3O4S MolecularWeight: 297.3302

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C(=O)C2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)N1CCN(CC1)C(=O)C2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O4S/c1-2-10(16)13-5-7-14(8-6-13)12(17)9-3-4-11(20-9)15(18)19/h3-4H,2,5-8H2,1H3