1-[3-[4-(4-nitrophenyl)piperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[3-[4-(4-nitrophenyl)piperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[3-[4-(4-nitrophenyl)piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[3-[[4-(4-nitrophenyl)-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[3-[4-(4-nitrophenyl)piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[3-[4-(4-nitrophenyl)piperazino]sulfonylphenyl]ethanone Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c1-14(22)15-3-2-4-18(13-15)27(25,26)20-11-9-19(10-12-20)16-5-7-17(8-6-16)21(23)24/h2-8,13H,9-12H2,1H3