2-oxidanyl-5-[1-oxidanyl-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]benzoic acid

Systemtic Name: 2-oxidanyl-5-[1-oxidanyl-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]benzoic acid Openeye Name: 2-hydroxy-5-[1-hydroxy-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]benzoic acid CAS Name: 2-hydroxy-5-[1-hydroxy-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]benzoic acid IUPAC Name: 2-hydroxy-5-[1-hydroxy-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]benzoic acid Traditional Name: 2-hydroxy-5-[1-hydroxy-2-[4-(2-pyridyl)piperazino]ethyl]benzoic acid Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(C2=CC(=C(C=C2)O)C(=O)O)O)C3=CC=CC=N3

Isomeric SMILES

C1CN(CCN1CC(C2=CC(=C(C=C2)O)C(=O)O)O)C3=CC=CC=N3

InChI

InChI=1S/C18H21N3O4/c22-15-5-4-13(11-14(15)18(24)25)16(23)12-20-7-9-21(10-8-20)17-3-1-2-6-19-17/h1-6,11,16,22-23H,7-10,12H2,(H,24,25)