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

Systemtic Name: (E)-4,4-dimethyl-1-(4-methylphenyl)-3-(1,2,4-triazol-1-ylmethyl)pent-1-en-3-ol Openeye Name: (E)-4,4-dimethyl-1-(p-tolyl)-3-(1,2,4-triazol-1-ylmethyl)pent-1-en-3-ol CAS Name: (E)-4,4-dimethyl-1-(4-methylphenyl)-3-(1,2,4-triazol-1-ylmethyl)-1-penten-3-ol IUPAC Name: (E)-4,4-dimethyl-1-(4-methylphenyl)-3-(1,2,4-triazol-1-ylmethyl)pent-1-en-3-ol Traditional Name: (E)-4,4-dimethyl-1-(p-tolyl)-3-(1,2,4-triazol-1-ylmethyl)pent-1-en-3-ol Formula: C17H23N3O MolecularWeight: 285.38402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(CN2C=NC=N2)(C(C)(C)C)O

InChI

InChI=1S/C17H23N3O/c1-14-5-7-15(8-6-14)9-10-17(21,16(2,3)4)11-20-13-18-12-19-20/h5-10,12-13,21H,11H2,1-4H3/b10-9+