7-(2-chloranyl-6-fluoranyl-phenoxy)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)heptan-3-ol

Systemtic Name: 7-(2-chloranyl-6-fluoranyl-phenoxy)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)heptan-3-ol Openeye Name: 7-(2-chloro-6-fluoro-phenoxy)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)heptan-3-ol CAS Name: 7-(2-chloro-6-fluorophenoxy)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)-3-heptanol IUPAC Name: 7-(2-chloro-6-fluorophenoxy)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)heptan-3-ol Traditional Name: 7-(2-chloro-6-fluoro-phenoxy)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)heptan-3-ol Formula: C17H23ClFN3O2 MolecularWeight: 355.834823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(CCCOC1=C(C=CC=C1Cl)F)N2C=NC=N2)O

Isomeric SMILES

CC(C)(C)C(C(CCCOC1=C(C=CC=C1Cl)F)N2C=NC=N2)O

InChI

InChI=1S/C17H23ClFN3O2/c1-17(2,3)16(23)14(22-11-20-10-21-22)8-5-9-24-15-12(18)6-4-7-13(15)19/h4,6-7,10-11,14,16,23H,5,8-9H2,1-3H3