(E)-4-methoxy-4-methyl-1-(2-methylphenyl)-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol

Systemtic Name: (E)-4-methoxy-4-methyl-1-(2-methylphenyl)-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol Openeye Name: (E)-4-methoxy-4-methyl-1-(o-tolyl)-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol CAS Name: (E)-4-methoxy-4-methyl-1-(2-methylphenyl)-2-(1,2,4-triazol-1-yl)-1-penten-3-ol IUPAC Name: (E)-4-methoxy-4-methyl-1-(2-methylphenyl)-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol Traditional Name: (E)-4-methoxy-4-methyl-1-(o-tolyl)-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C(C(C(C)(C)OC)O)N2C=NC=N2

Isomeric SMILES

CC1=CC=CC=C1/C=C(\C(C(C)(C)OC)O)/N2C=NC=N2

InChI

InChI=1S/C16H21N3O2/c1-12-7-5-6-8-13(12)9-14(19-11-17-10-18-19)15(20)16(2,3)21-4/h5-11,15,20H,1-4H3/b14-9+