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

Systemtic Name: (4-ethylphenyl)methyl-[2-(hydroxymethyl)-1,3-bis(oxidanyl)propan-2-yl]azanium Openeye Name: (4-ethylphenyl)methyl-[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]ammonium CAS Name: [1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-[(4-ethylphenyl)methyl]ammonium IUPAC Name: [1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-[(4-ethylphenyl)methyl]azanium Traditional Name: (4-ethylbenzyl)-(2-hydroxy-1,1-dimethylol-ethyl)ammonium Formula: C13H22NO3+ MolecularWeight: 240.31868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO3/c1-2-11-3-5-12(6-4-11)7-14-13(8-15,9-16)10-17/h3-6,14-17H,2,7-10H2,1H3/p+1