bis(furan-2-ylmethyl)-[2-oxidanylidene-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethyl]azanium

Systemtic Name: bis(furan-2-ylmethyl)-[2-oxidanylidene-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethyl]azanium Openeye Name: [2-(4-benzylsulfonylpiperazin-1-yl)-2-oxo-ethyl]-bis(2-furylmethyl)ammonium CAS Name: bis(2-furanylmethyl)-[2-oxo-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethyl]ammonium IUPAC Name: [2-(4-benzylsulfonylpiperazin-1-yl)-2-oxoethyl]-bis(furan-2-ylmethyl)azanium Traditional Name: [2-(4-benzylsulfonylpiperazino)-2-keto-ethyl]-bis(2-furfuryl)ammonium Formula: C23H28N3O5S+ MolecularWeight: 458.55052

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C[NH+](CC2=CC=CO2)CC3=CC=CO3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C[NH+](CC2=CC=CO2)CC3=CC=CO3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O5S/c27-23(18-24(16-21-8-4-14-30-21)17-22-9-5-15-31-22)25-10-12-26(13-11-25)32(28,29)19-20-6-2-1-3-7-20/h1-9,14-15H,10-13,16-19H2/p+1