2-[[ethyl(2-hydroxyethyl)azaniumyl]methyl]benzoate

Systemtic Name: 2-[[ethyl(2-hydroxyethyl)azaniumyl]methyl]benzoate Openeye Name: 2-[[ethyl(2-hydroxyethyl)ammonio]methyl]benzoate CAS Name: 2-[[ethyl(2-hydroxyethyl)ammonio]methyl]benzoate IUPAC Name: 2-[[ethyl(2-hydroxyethyl)azaniumyl]methyl]benzoate Traditional Name: 2-[[ethyl(2-hydroxyethyl)ammonio]methyl]benzoate Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCO)CC1=CC=CC=C1C(=O)[O-]

Isomeric SMILES

CC[NH+](CCO)CC1=CC=CC=C1C(=O)[O-]

InChI

InChI=1S/C12H17NO3/c1-2-13(7-8-14)9-10-5-3-4-6-11(10)12(15)16/h3-6,14H,2,7-9H2,1H3,(H,15,16)