1-(3,4-dimethoxyphenyl)sulfonyl-4-(thiophen-2-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-(thiophen-2-ylmethyl)piperazin-4-ium Openeye Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-(2-thienylmethyl)piperazin-4-ium CAS Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-(thiophen-2-ylmethyl)piperazin-4-ium IUPAC Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-(thiophen-2-ylmethyl)piperazin-4-ium Traditional Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-(2-thenyl)piperazin-4-ium Formula: C17H23N2O4S2+ MolecularWeight: 383.50552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CS3)OC

InChI

InChI=1S/C17H22N2O4S2/c1-22-16-6-5-15(12-17(16)23-2)25(20,21)19-9-7-18(8-10-19)13-14-4-3-11-24-14/h3-6,11-12H,7-10,13H2,1-2H3/p+1