2-[4-[3-(2-oxidanylphenoxy)propanoyl]piperazin-1-yl]ethanesulfonic acid

Systemtic Name: 2-[4-[3-(2-oxidanylphenoxy)propanoyl]piperazin-1-yl]ethanesulfonic acid Openeye Name: 2-[4-[3-(2-hydroxyphenoxy)propanoyl]piperazin-1-yl]ethanesulfonic acid CAS Name: 2-[4-[3-(2-hydroxyphenoxy)-1-oxopropyl]-1-piperazinyl]ethanesulfonic acid IUPAC Name: 2-[4-[3-(2-hydroxyphenoxy)propanoyl]piperazin-1-yl]ethanesulfonic acid Traditional Name: 2-[4-[3-(2-hydroxyphenoxy)propanoyl]piperazino]ethanesulfonic acid Formula: C15H22N2O6S MolecularWeight: 358.40998

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCS(=O)(=O)O)C(=O)CCOC2=CC=CC=C2O

Isomeric SMILES

C1CN(CCN1CCS(=O)(=O)O)C(=O)CCOC2=CC=CC=C2O

InChI

InChI=1S/C15H22N2O6S/c18-13-3-1-2-4-14(13)23-11-5-15(19)17-8-6-16(7-9-17)10-12-24(20,21)22/h1-4,18H,5-12H2,(H,20,21,22)