1-(3-bromanyl-4-fluoranyl-phenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)oct-7-en-3-ol

Systemtic Name: 1-(3-bromanyl-4-fluoranyl-phenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)oct-7-en-3-ol Openeye Name: 1-(3-bromo-4-fluoro-phenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)oct-7-en-3-ol CAS Name: 1-(3-bromo-4-fluorophenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)-7-octen-3-ol IUPAC Name: 1-(3-bromo-4-fluorophenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)oct-7-en-3-ol Traditional Name: 1-(3-bromo-4-fluoro-phenyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)oct-7-en-3-ol Formula: C18H23BrFN3O MolecularWeight: 396.297123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC(=C(C=C1)F)Br)C(C(CCC=C)N2C=NC=N2)O

Isomeric SMILES

CC(C)(CC1=CC(=C(C=C1)F)Br)C(C(CCC=C)N2C=NC=N2)O

InChI

InChI=1S/C18H23BrFN3O/c1-4-5-6-16(23-12-21-11-22-23)17(24)18(2,3)10-13-7-8-15(20)14(19)9-13/h4,7-9,11-12,16-17,24H,1,5-6,10H2,2-3H3