[3-(2-piperazin-1-ylethoxy)phenyl] 2-chloranylbenzenesulfonate

Systemtic Name: [3-(2-piperazin-1-ylethoxy)phenyl] 2-chloranylbenzenesulfonate Openeye Name: [3-(2-piperazin-1-ylethoxy)phenyl] 2-chlorobenzenesulfonate CAS Name: 2-chlorobenzenesulfonic acid [3-[2-(1-piperazinyl)ethoxy]phenyl] ester IUPAC Name: [3-(2-piperazin-1-ylethoxy)phenyl] 2-chlorobenzenesulfonate Traditional Name: 2-chlorobenzenesulfonic acid [3-(2-piperazinoethoxy)phenyl] ester Formula: C18H21ClN2O4S MolecularWeight: 396.88834

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCOC2=CC(=CC=C2)OS(=O)(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CCN1)CCOC2=CC(=CC=C2)OS(=O)(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H21ClN2O4S/c19-17-6-1-2-7-18(17)26(22,23)25-16-5-3-4-15(14-16)24-13-12-21-10-8-20-9-11-21/h1-7,14,20H,8-13H2