1-[3-(4-methoxyphenoxy)propyl]-4-thiophen-2-ylsulfonyl-piperazin-1-ium

Systemtic Name: 1-[3-(4-methoxyphenoxy)propyl]-4-thiophen-2-ylsulfonyl-piperazin-1-ium Openeye Name: 1-[3-(4-methoxyphenoxy)propyl]-4-(2-thienylsulfonyl)piperazin-1-ium CAS Name: 1-[3-(4-methoxyphenoxy)propyl]-4-thiophen-2-ylsulfonylpiperazin-1-ium IUPAC Name: 1-[3-(4-methoxyphenoxy)propyl]-4-thiophen-2-ylsulfonylpiperazin-1-ium Traditional Name: 1-[3-(4-methoxyphenoxy)propyl]-4-(2-thienylsulfonyl)piperazin-1-ium Formula: C18H25N2O4S2+ MolecularWeight: 397.5321

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCC[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)OCCC[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H24N2O4S2/c1-23-16-5-7-17(8-6-16)24-14-3-9-19-10-12-20(13-11-19)26(21,22)18-4-2-15-25-18/h2,4-8,15H,3,9-14H2,1H3/p+1