N-[4-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]phenyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[4-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]phenyl]-2-nitro-benzenesulfonamide Openeye Name: N-[4-[[4-(2-furylmethyl)piperazin-1-yl]methyl]phenyl]-2-nitro-benzenesulfonamide CAS Name: N-[4-[[4-(2-furanylmethyl)-1-piperazinyl]methyl]phenyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[4-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]phenyl]-2-nitrobenzenesulfonamide Traditional Name: N-[4-[[4-(2-furfuryl)piperazino]methyl]phenyl]-2-nitro-benzenesulfonamide Formula: C22H24N4O5S MolecularWeight: 456.51476

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])CC4=CC=CO4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])CC4=CC=CO4

InChI

InChI=1S/C22H24N4O5S/c27-26(28)21-5-1-2-6-22(21)32(29,30)23-19-9-7-18(8-10-19)16-24-11-13-25(14-12-24)17-20-4-3-15-31-20/h1-10,15,23H,11-14,16-17H2