[3-[4-(benzotriazol-2-yl)-3-oxidanyl-phenoxy]-2-oxidanyl-propyl]-trimethyl-azanium chloride

Systemtic Name: [3-[4-(benzotriazol-2-yl)-3-oxidanyl-phenoxy]-2-oxidanyl-propyl]-trimethyl-azanium chloride Openeye Name: [3-[4-(benzotriazol-2-yl)-3-hydroxy-phenoxy]-2-hydroxy-propyl]-trimethyl-ammonium chloride CAS Name: [3-[4-(2-benzotriazolyl)-3-hydroxyphenoxy]-2-hydroxypropyl]-trimethylammonium chloride IUPAC Name: [3-[4-(benzotriazol-2-yl)-3-hydroxyphenoxy]-2-hydroxypropyl]-trimethylazanium chloride Traditional Name: [3-[4-(benzotriazol-2-yl)-3-hydroxy-phenoxy]-2-hydroxy-propyl]-trimethyl-ammonium chloride Formula: C18H23ClN4O3 MolecularWeight: 378.85322

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(COC1=CC(=C(C=C1)N2N=C3C=CC=CC3=N2)O)O.[Cl-]

Isomeric SMILES

C[N+](C)(C)CC(COC1=CC(=C(C=C1)N2N=C3C=CC=CC3=N2)O)O.[Cl-]

InChI

InChI=1S/C18H22N4O3.ClH/c1-22(2,3)11-13(23)12-25-14-8-9-17(18(24)10-14)21-19-15-6-4-5-7-16(15)20-21;/h4-10,13,23H,11-12H2,1-3H3;1H