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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(N1CCN(CC1)C2=CC=CC=C2C(=O)O)OC3=CC=C(C=C3)O)O

Isomeric SMILES

CC(C(N1CCN(CC1)C2=CC=CC=C2C(=O)O)OC3=CC=C(C=C3)O)O

InChI

InChI=1S/C20H24N2O5/c1-14(23)19(27-16-8-6-15(24)7-9-16)22-12-10-21(11-13-22)18-5-3-2-4-17(18)20(25)26/h2-9,14,19,23-24H,10-13H2,1H3,(H,25,26)