(4-ethylpiperazin-1-yl) 4-methylbenzenesulfonate

Systemtic Name: (4-ethylpiperazin-1-yl) 4-methylbenzenesulfonate Openeye Name: (4-ethylpiperazin-1-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4-ethyl-1-piperazinyl) ester IUPAC Name: (4-ethylpiperazin-1-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-ethylpiperazino) ester Formula: C13H20N2O3S MolecularWeight: 284.3745

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCN1CCN(CC1)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C13H20N2O3S/c1-3-14-8-10-15(11-9-14)18-19(16,17)13-6-4-12(2)5-7-13/h4-7H,3,8-11H2,1-2H3