1-[4-(2-methoxy-4-nitro-phenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-(2-methoxy-4-nitro-phenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-(2-methoxy-4-nitro-phenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 1-[4-(2-methoxy-4-nitrophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-[4-(2-methoxy-4-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 1-[4-(2-methoxy-4-nitro-phenyl)sulfonylpiperazino]ethanone Formula: C13H17N3O6S MolecularWeight: 343.35558

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C13H17N3O6S/c1-10(17)14-5-7-15(8-6-14)23(20,21)13-4-3-11(16(18)19)9-12(13)22-2/h3-4,9H,5-8H2,1-2H3