1-(furan-2-ylmethyl)-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-(furan-2-ylmethyl)-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-(2-furylmethyl)-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium CAS Name: 1-(2-furanylmethyl)-4-(4-methoxyphenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-(furan-2-ylmethyl)-4-(4-methoxyphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-(2-furfuryl)-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium Formula: C16H21N2O4S+ MolecularWeight: 337.41394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CO3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CO3

InChI

InChI=1S/C16H20N2O4S/c1-21-14-4-6-16(7-5-14)23(19,20)18-10-8-17(9-11-18)13-15-3-2-12-22-15/h2-7,12H,8-11,13H2,1H3/p+1