1-[2-(4-methoxyphenyl)ethyl]-4-thiophen-2-ylsulfonyl-piperazin-1-ium

Systemtic Name: 1-[2-(4-methoxyphenyl)ethyl]-4-thiophen-2-ylsulfonyl-piperazin-1-ium Openeye Name: 1-[2-(4-methoxyphenyl)ethyl]-4-(2-thienylsulfonyl)piperazin-1-ium CAS Name: 1-[2-(4-methoxyphenyl)ethyl]-4-thiophen-2-ylsulfonylpiperazin-1-ium IUPAC Name: 1-[2-(4-methoxyphenyl)ethyl]-4-thiophen-2-ylsulfonylpiperazin-1-ium Traditional Name: 1-[2-(4-methoxyphenyl)ethyl]-4-(2-thienylsulfonyl)piperazin-1-ium Formula: C17H23N2O3S2+ MolecularWeight: 367.50612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O3S2/c1-22-16-6-4-15(5-7-16)8-9-18-10-12-19(13-11-18)24(20,21)17-3-2-14-23-17/h2-7,14H,8-13H2,1H3/p+1