(3,5-dinitrophenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (3,5-dinitrophenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(3,5-dinitrophenyl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-(3,5-dinitrophenyl)methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(3,5-dinitrophenyl)methanone Traditional Name: (4-besylpiperazino)-(3,5-dinitrophenyl)methanone Formula: C17H16N4O7S MolecularWeight: 420.39654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N4O7S/c22-17(13-10-14(20(23)24)12-15(11-13)21(25)26)18-6-8-19(9-7-18)29(27,28)16-4-2-1-3-5-16/h1-5,10-12H,6-9H2