3-(1-oxidanyl-1-piperazin-2-yl-ethyl)benzoic acid

Systemtic Name: 3-(1-oxidanyl-1-piperazin-2-yl-ethyl)benzoic acid Openeye Name: 3-(1-hydroxy-1-piperazin-2-yl-ethyl)benzoic acid CAS Name: 3-[1-hydroxy-1-(2-piperazinyl)ethyl]benzoic acid IUPAC Name: 3-(1-hydroxy-1-piperazin-2-ylethyl)benzoic acid Traditional Name: 3-(1-hydroxy-1-piperazin-2-yl-ethyl)benzoic acid Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CNCCN1)(C2=CC=CC(=C2)C(=O)O)O

Isomeric SMILES

CC(C1CNCCN1)(C2=CC=CC(=C2)C(=O)O)O

InChI

InChI=1S/C13H18N2O3/c1-13(18,11-8-14-5-6-15-11)10-4-2-3-9(7-10)12(16)17/h2-4,7,11,14-15,18H,5-6,8H2,1H3,(H,16,17)