(3-nitrophenyl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (3-nitrophenyl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (3-nitrophenyl)-[4-(3-pyridylsulfonyl)piperazin-1-yl]methanone CAS Name: (3-nitrophenyl)-[4-(3-pyridinylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (3-nitrophenyl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (3-nitrophenyl)-[4-(3-pyridylsulfonyl)piperazino]methanone Formula: C16H16N4O5S MolecularWeight: 376.38704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N4O5S/c21-16(13-3-1-4-14(11-13)20(22)23)18-7-9-19(10-8-18)26(24,25)15-5-2-6-17-12-15/h1-6,11-12H,7-10H2