2-(4-nitrophenyl)-1-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(4-nitrophenyl)-1-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-(4-nitrophenyl)-1-[4-(3-pyridylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-(4-nitrophenyl)-1-[4-(3-pyridinylsulfonyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-nitrophenyl)-1-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-(4-nitrophenyl)-1-[4-(3-pyridylsulfonyl)piperazino]ethanone Formula: C17H18N4O5S MolecularWeight: 390.41362

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C17H18N4O5S/c22-17(12-14-3-5-15(6-4-14)21(23)24)19-8-10-20(11-9-19)27(25,26)16-2-1-7-18-13-16/h1-7,13H,8-12H2