(E)-2-methyl-3-phenyl-4-(1,2,4-triazol-1-yl)but-3-en-2-ol

Systemtic Name: (E)-2-methyl-3-phenyl-4-(1,2,4-triazol-1-yl)but-3-en-2-ol Openeye Name: (E)-2-methyl-3-phenyl-4-(1,2,4-triazol-1-yl)but-3-en-2-ol CAS Name: (E)-2-methyl-3-phenyl-4-(1,2,4-triazol-1-yl)-3-buten-2-ol IUPAC Name: (E)-2-methyl-3-phenyl-4-(1,2,4-triazol-1-yl)but-3-en-2-ol Traditional Name: (E)-2-methyl-3-phenyl-4-(1,2,4-triazol-1-yl)but-3-en-2-ol Formula: C13H15N3O MolecularWeight: 229.2777

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(/C(=C/N1C=NC=N1)/C2=CC=CC=C2)O

InChI

InChI=1S/C13H15N3O/c1-13(2,17)12(8-16-10-14-9-15-16)11-6-4-3-5-7-11/h3-10,17H,1-2H3/b12-8+