(4-ethylphenyl)methyl-[2-methyl-1,3-bis(oxidanyl)propan-2-yl]azanium

Systemtic Name: (4-ethylphenyl)methyl-[2-methyl-1,3-bis(oxidanyl)propan-2-yl]azanium Openeye Name: (4-ethylphenyl)methyl-[2-hydroxy-1-(hydroxymethyl)-1-methyl-ethyl]ammonium CAS Name: (1,3-dihydroxy-2-methylpropan-2-yl)-[(4-ethylphenyl)methyl]ammonium IUPAC Name: (1,3-dihydroxy-2-methylpropan-2-yl)-[(4-ethylphenyl)methyl]azanium Traditional Name: (4-ethylbenzyl)-(2-hydroxy-1-methyl-1-methylol-ethyl)ammonium Formula: C13H22NO2+ MolecularWeight: 224.31928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH2+]C(C)(CO)CO

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH2+]C(C)(CO)CO

InChI

InChI=1S/C13H21NO2/c1-3-11-4-6-12(7-5-11)8-14-13(2,9-15)10-16/h4-7,14-16H,3,8-10H2,1-2H3/p+1