phenyl 2-(4-phenylpiperazin-1-yl)ethanesulfonate

Systemtic Name: phenyl 2-(4-phenylpiperazin-1-yl)ethanesulfonate Openeye Name: phenyl 2-(4-phenylpiperazin-1-yl)ethanesulfonate CAS Name: 2-(4-phenyl-1-piperazinyl)ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-(4-phenylpiperazin-1-yl)ethanesulfonate Traditional Name: 2-(4-phenylpiperazino)ethanesulfonic acid phenyl ester Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCS(=O)(=O)OC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCS(=O)(=O)OC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H22N2O3S/c21-24(22,23-18-9-5-2-6-10-18)16-15-19-11-13-20(14-12-19)17-7-3-1-4-8-17/h1-10H,11-16H2