1-(3,4-dimethylphenyl)sulfonyl-4-(furan-2-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(3,4-dimethylphenyl)sulfonyl-4-(furan-2-ylmethyl)piperazin-4-ium Openeye Name: 1-(3,4-dimethylphenyl)sulfonyl-4-(2-furylmethyl)piperazin-4-ium CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-4-(2-furanylmethyl)piperazin-4-ium IUPAC Name: 1-(3,4-dimethylphenyl)sulfonyl-4-(furan-2-ylmethyl)piperazin-4-ium Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-4-(2-furfuryl)piperazin-4-ium Formula: C17H23N2O3S+ MolecularWeight: 335.44112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CO3)C

InChI

InChI=1S/C17H22N2O3S/c1-14-5-6-17(12-15(14)2)23(20,21)19-9-7-18(8-10-19)13-16-4-3-11-22-16/h3-6,11-12H,7-10,13H2,1-2H3/p+1