(5-fluoranyl-3-methyl-1-benzofuran-2-yl)-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (5-fluoranyl-3-methyl-1-benzofuran-2-yl)-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (5-fluoro-3-methyl-benzofuran-2-yl)-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (5-fluoro-3-methyl-2-benzofuranyl)-[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (5-fluoro-3-methyl-1-benzofuran-2-yl)-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (5-fluoro-3-methyl-benzofuran-2-yl)-(4-nosylpiperazino)methanone Formula: C20H18FN3O6S MolecularWeight: 447.436823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)F)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)F)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H18FN3O6S/c1-13-17-12-14(21)2-7-18(17)30-19(13)20(25)22-8-10-23(11-9-22)31(28,29)16-5-3-15(4-6-16)24(26)27/h2-7,12H,8-11H2,1H3