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

Systemtic Name: furan-2-ylmethyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-(2-furylmethyl)-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]ammonium CAS Name: 2-furanylmethyl-[2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-(furan-2-ylmethyl)-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl]azanium Traditional Name: benzyl-(2-furfuryl)-[2-keto-2-(4-mesylpiperazino)ethyl]ammonium Formula: C19H26N3O4S+ MolecularWeight: 392.49244

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)C[NH+](CC2=CC=CC=C2)CC3=CC=CO3

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)C[NH+](CC2=CC=CC=C2)CC3=CC=CO3

InChI

InChI=1S/C19H25N3O4S/c1-27(24,25)22-11-9-21(10-12-22)19(23)16-20(15-18-8-5-13-26-18)14-17-6-3-2-4-7-17/h2-8,13H,9-12,14-16H2,1H3/p+1