1-benzofuran-2-yl-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: 1-benzofuran-2-yl-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: benzofuran-2-yl-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone CAS Name: 2-benzofuranyl-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: 1-benzofuran-2-yl-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: benzofuran-2-yl-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]methanone Formula: C20H19N3O7S MolecularWeight: 445.44576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4O3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4O3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O7S/c1-29-18-7-6-15(13-16(18)23(25)26)31(27,28)22-10-8-21(9-11-22)20(24)19-12-14-4-2-3-5-17(14)30-19/h2-7,12-13H,8-11H2,1H3