1-(3,4-diethoxyphenyl)sulfonylpiperazin-4-ium

Systemtic Name: 1-(3,4-diethoxyphenyl)sulfonylpiperazin-4-ium Openeye Name: 1-(3,4-diethoxyphenyl)sulfonylpiperazin-4-ium CAS Name: 1-(3,4-diethoxyphenyl)sulfonylpiperazin-4-ium IUPAC Name: 1-(3,4-diethoxyphenyl)sulfonylpiperazin-4-ium Traditional Name: 1-(3,4-diethoxyphenyl)sulfonylpiperazin-4-ium Formula: C14H23N2O4S+ MolecularWeight: 315.40842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH2+]CC2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH2+]CC2)OCC

InChI

InChI=1S/C14H22N2O4S/c1-3-19-13-6-5-12(11-14(13)20-4-2)21(17,18)16-9-7-15-8-10-16/h5-6,11,15H,3-4,7-10H2,1-2H3/p+1