2-(4-ethanoyl-2-methoxy-phenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(4-ethanoyl-2-methoxy-phenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(4-acetyl-2-methoxy-phenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(4-acetyl-2-methoxyphenoxy)-1-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(4-acetyl-2-methoxyphenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(4-acetyl-2-methoxy-phenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazino]ethanone Formula: C21H23N3O8S MolecularWeight: 477.48762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O8S/c1-15(25)16-6-7-19(20(12-16)31-2)32-14-21(26)22-8-10-23(11-9-22)33(29,30)18-5-3-4-17(13-18)24(27)28/h3-7,12-13H,8-11,14H2,1-2H3