8-(2-bromanylpyridin-3-yl)oxy-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-ol

Systemtic Name: 8-(2-bromanylpyridin-3-yl)oxy-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-ol Openeye Name: 8-[(2-bromo-3-pyridyl)oxy]-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-ol CAS Name: 8-[(2-bromo-3-pyridinyl)oxy]-2,2-dimethyl-4-(1,2,4-triazol-1-yl)-3-octanol IUPAC Name: 8-(2-bromopyridin-3-yl)oxy-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-ol Traditional Name: 8-[(2-bromo-3-pyridyl)oxy]-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-ol Formula: C17H25BrN4O2 MolecularWeight: 397.31

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(CCCCOC1=C(N=CC=C1)Br)N2C=NC=N2)O

Isomeric SMILES

CC(C)(C)C(C(CCCCOC1=C(N=CC=C1)Br)N2C=NC=N2)O

InChI

InChI=1S/C17H25BrN4O2/c1-17(2,3)15(23)13(22-12-19-11-21-22)7-4-5-10-24-14-8-6-9-20-16(14)18/h6,8-9,11-13,15,23H,4-5,7,10H2,1-3H3