2-(4-azanyl-2-oxidanyl-phenoxy)ethyl-pentan-3-yl-azanium chloride

Systemtic Name: 2-(4-azanyl-2-oxidanyl-phenoxy)ethyl-pentan-3-yl-azanium chloride Openeye Name: 2-(4-amino-2-hydroxy-phenoxy)ethyl-(1-ethylpropyl)ammonium chloride CAS Name: 2-(4-amino-2-hydroxyphenoxy)ethyl-pentan-3-ylammonium chloride IUPAC Name: 2-(4-amino-2-hydroxyphenoxy)ethyl-pentan-3-ylazanium chloride Traditional Name: 2-(4-amino-2-hydroxy-phenoxy)ethyl-(1-ethylpropyl)ammonium chloride Formula: C13H23ClN2O2 MolecularWeight: 274.78692

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CCOC1=C(C=C(C=C1)N)O.[Cl-]

Isomeric SMILES

CCC(CC)[NH2+]CCOC1=C(C=C(C=C1)N)O.[Cl-]

InChI

InChI=1S/C13H22N2O2.ClH/c1-3-11(4-2)15-7-8-17-13-6-5-10(14)9-12(13)16;/h5-6,9,11,15-16H,3-4,7-8,14H2,1-2H3;1H