1-(4-ethanoylpiperazin-1-yl)-2-(4-nitro-2-thiophen-2-yl-phenoxy)ethanone

Systemtic Name: 1-(4-ethanoylpiperazin-1-yl)-2-(4-nitro-2-thiophen-2-yl-phenoxy)ethanone Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-[4-nitro-2-(2-thienyl)phenoxy]ethanone CAS Name: 1-(4-acetyl-1-piperazinyl)-2-(4-nitro-2-thiophen-2-ylphenoxy)ethanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-(4-nitro-2-thiophen-2-ylphenoxy)ethanone Traditional Name: 1-(4-acetylpiperazino)-2-[4-nitro-2-(2-thienyl)phenoxy]ethanone Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=CS3

InChI

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