2-[4-[2-oxidanyl-3-(4-oxidanylphenoxy)propyl]piperazin-1-yl]benzoic acid

Systemtic Name: 2-[4-[2-oxidanyl-3-(4-oxidanylphenoxy)propyl]piperazin-1-yl]benzoic acid Openeye Name: 2-[4-[2-hydroxy-3-(4-hydroxyphenoxy)propyl]piperazin-1-yl]benzoic acid CAS Name: 2-[4-[2-hydroxy-3-(4-hydroxyphenoxy)propyl]-1-piperazinyl]benzoic acid IUPAC Name: 2-[4-[2-hydroxy-3-(4-hydroxyphenoxy)propyl]piperazin-1-yl]benzoic acid Traditional Name: 2-[4-[2-hydroxy-3-(4-hydroxyphenoxy)propyl]piperazino]benzoic acid Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=C(C=C2)O)O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=C(C=C2)O)O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C20H24N2O5/c23-15-5-7-17(8-6-15)27-14-16(24)13-21-9-11-22(12-10-21)19-4-2-1-3-18(19)20(25)26/h1-8,16,23-24H,9-14H2,(H,25,26)