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

Systemtic Name: [3-[4-(benzotriazol-2-yl)-3-oxidanyl-phenoxy]-2-oxidanyl-propyl]-trimethyl-azanium Openeye Name: [3-[4-(benzotriazol-2-yl)-3-hydroxy-phenoxy]-2-hydroxy-propyl]-trimethyl-ammonium CAS Name: [3-[4-(2-benzotriazolyl)-3-hydroxyphenoxy]-2-hydroxypropyl]-trimethylammonium IUPAC Name: [3-[4-(benzotriazol-2-yl)-3-hydroxyphenoxy]-2-hydroxypropyl]-trimethylazanium Traditional Name: [3-[4-(benzotriazol-2-yl)-3-hydroxy-phenoxy]-2-hydroxy-propyl]-trimethyl-ammonium Formula: C18H23N4O3+ MolecularWeight: 343.40022

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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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O3/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/p+1