2-(6-methoxy-1-benzofuran-3-yl)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(6-methoxy-1-benzofuran-3-yl)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(6-methoxybenzofuran-3-yl)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(6-methoxy-3-benzofuranyl)-1-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(6-methoxy-1-benzofuran-3-yl)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(6-methoxybenzofuran-3-yl)-1-[4-(3-nitrophenyl)sulfonylpiperazino]ethanone Formula: C21H21N3O7S MolecularWeight: 459.47234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CO2)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CO2)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O7S/c1-30-17-5-6-19-15(14-31-20(19)13-17)11-21(25)22-7-9-23(10-8-22)32(28,29)18-4-2-3-16(12-18)24(26)27/h2-6,12-14H,7-11H2,1H3