[4-(4-nitrophenyl)piperazin-1-yl]-(phenylsulfonyl)methanone

Systemtic Name: [4-(4-nitrophenyl)piperazin-1-yl]-(phenylsulfonyl)methanone Openeye Name: benzenesulfonyl-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: benzenesulfonyl-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: benzenesulfonyl-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: besyl-[4-(4-nitrophenyl)piperazino]methanone Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H17N3O5S/c21-17(26(24,25)16-4-2-1-3-5-16)19-12-10-18(11-13-19)14-6-8-15(9-7-14)20(22)23/h1-9H,10-13H2