3,3-dimethyl-1-(4-phenylphenoxy)-2-(1,2,4-triazol-1-ylmethyl)pent-4-en-2-ol

Systemtic Name: 3,3-dimethyl-1-(4-phenylphenoxy)-2-(1,2,4-triazol-1-ylmethyl)pent-4-en-2-ol Openeye Name: 3,3-dimethyl-1-(4-phenylphenoxy)-2-(1,2,4-triazol-1-ylmethyl)pent-4-en-2-ol CAS Name: 3,3-dimethyl-1-(4-phenylphenoxy)-2-(1,2,4-triazol-1-ylmethyl)-4-penten-2-ol IUPAC Name: 3,3-dimethyl-1-(4-phenylphenoxy)-2-(1,2,4-triazol-1-ylmethyl)pent-4-en-2-ol Traditional Name: 3,3-dimethyl-1-(4-phenylphenoxy)-2-(1,2,4-triazol-1-ylmethyl)pent-4-en-2-ol Formula: C22H25N3O2 MolecularWeight: 363.4528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=C)C(CN1C=NC=N1)(COC2=CC=C(C=C2)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C=C)C(CN1C=NC=N1)(COC2=CC=C(C=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C22H25N3O2/c1-4-21(2,3)22(26,14-25-17-23-16-24-25)15-27-20-12-10-19(11-13-20)18-8-6-5-7-9-18/h4-13,16-17,26H,1,14-15H2,2-3H3