2-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]benzoate

Systemtic Name: 2-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]benzoate Openeye Name: 2-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]benzoate CAS Name: 2-[[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]methyl]benzoate IUPAC Name: 2-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]benzoate Traditional Name: 2-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]benzoate Formula: C14H20N2O3 MolecularWeight: 264.3202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2C(=O)[O-])CCO

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2C(=O)[O-])CCO

InChI

InChI=1S/C14H20N2O3/c17-10-9-15-5-7-16(8-6-15)11-12-3-1-2-4-13(12)14(18)19/h1-4,17H,5-11H2,(H,18,19)