4-fluoranyl-3,3-dimethyl-1-(4-methylphenoxy)-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol

Systemtic Name: 4-fluoranyl-3,3-dimethyl-1-(4-methylphenoxy)-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol Openeye Name: 4-fluoro-3,3-dimethyl-1-(4-methylphenoxy)-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol CAS Name: 4-fluoro-3,3-dimethyl-1-(4-methylphenoxy)-2-(1,2,4-triazol-1-ylmethyl)-2-butanol IUPAC Name: 4-fluoro-3,3-dimethyl-1-(4-methylphenoxy)-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol Traditional Name: 4-fluoro-3,3-dimethyl-1-(4-methylphenoxy)-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol Formula: C16H22FN3O2 MolecularWeight: 307.363183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(CN2C=NC=N2)(C(C)(C)CF)O

Isomeric SMILES

CC1=CC=C(C=C1)OCC(CN2C=NC=N2)(C(C)(C)CF)O

InChI

InChI=1S/C16H22FN3O2/c1-13-4-6-14(7-5-13)22-10-16(21,15(2,3)8-17)9-20-12-18-11-19-20/h4-7,11-12,21H,8-10H2,1-3H3