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

Systemtic Name: (5-bromanylfuran-2-yl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (5-bromo-2-furyl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (5-bromo-2-furanyl)-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (5-bromofuran-2-yl)-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (5-bromo-2-furyl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]methanone Formula: C16H16BrN3O7S MolecularWeight: 474.28314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(O3)Br)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(O3)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H16BrN3O7S/c1-26-13-3-2-11(10-12(13)20(22)23)28(24,25)19-8-6-18(7-9-19)16(21)14-4-5-15(17)27-14/h2-5,10H,6-9H2,1H3