2-(4-chloranyl-2-nitro-phenoxy)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(4-chloranyl-2-nitro-phenoxy)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-(4-chloro-2-nitro-phenoxy)-1-[4-(2-naphthylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-(4-chloro-2-nitrophenoxy)-1-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-chloro-2-nitrophenoxy)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-(4-chloro-2-nitro-phenoxy)-1-[4-(2-naphthylsulfonyl)piperazino]ethanone Formula: C22H20ClN3O6S MolecularWeight: 489.9287

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=C(C=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C(=O)COC2=C(C=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H20ClN3O6S/c23-18-6-8-21(20(14-18)26(28)29)32-15-22(27)24-9-11-25(12-10-24)33(30,31)19-7-5-16-3-1-2-4-17(16)13-19/h1-8,13-14H,9-12,15H2