(2-ethoxyphenyl)methyl-[(2S)-1-oxidanylbutan-2-yl]azanium

Systemtic Name: (2-ethoxyphenyl)methyl-[(2S)-1-oxidanylbutan-2-yl]azanium Openeye Name: (2-ethoxyphenyl)methyl-[(1S)-1-(hydroxymethyl)propyl]ammonium CAS Name: (2-ethoxyphenyl)methyl-[(2S)-1-hydroxybutan-2-yl]ammonium IUPAC Name: (2-ethoxyphenyl)methyl-[(2S)-1-hydroxybutan-2-yl]azanium Traditional Name: (2-ethoxybenzyl)-[(1S)-1-methylolpropyl]ammonium Formula: C13H22NO2+ MolecularWeight: 224.31928

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[NH2+]CC1=CC=CC=C1OCC

Isomeric SMILES

CC[C@@H](CO)[NH2+]CC1=CC=CC=C1OCC

InChI

InChI=1S/C13H21NO2/c1-3-12(10-15)14-9-11-7-5-6-8-13(11)16-4-2/h5-8,12,14-15H,3-4,9-10H2,1-2H3/p+1/t12-/m0/s1