3-[(4-bromanylphenoxy)methyl]-2,2-dimethyl-4-(1,2,4-triazol-1-yl)pentan-3-ol

Systemtic Name: 3-[(4-bromanylphenoxy)methyl]-2,2-dimethyl-4-(1,2,4-triazol-1-yl)pentan-3-ol Openeye Name: 3-[(4-bromophenoxy)methyl]-2,2-dimethyl-4-(1,2,4-triazol-1-yl)pentan-3-ol CAS Name: 3-[(4-bromophenoxy)methyl]-2,2-dimethyl-4-(1,2,4-triazol-1-yl)-3-pentanol IUPAC Name: 3-[(4-bromophenoxy)methyl]-2,2-dimethyl-4-(1,2,4-triazol-1-yl)pentan-3-ol Traditional Name: 3-[(4-bromophenoxy)methyl]-2,2-dimethyl-4-(1,2,4-triazol-1-yl)pentan-3-ol Formula: C16H22BrN3O2 MolecularWeight: 368.26878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(COC1=CC=C(C=C1)Br)(C(C)(C)C)O)N2C=NC=N2

Isomeric SMILES

CC(C(COC1=CC=C(C=C1)Br)(C(C)(C)C)O)N2C=NC=N2

InChI

InChI=1S/C16H22BrN3O2/c1-12(20-11-18-10-19-20)16(21,15(2,3)4)9-22-14-7-5-13(17)6-8-14/h5-8,10-12,21H,9H2,1-4H3