1,2-bis(4-methylphenyl)-3-(1,2,4-triazol-1-yl)propane-1,2-diol

Systemtic Name: 1,2-bis(4-methylphenyl)-3-(1,2,4-triazol-1-yl)propane-1,2-diol Openeye Name: 1,2-bis(p-tolyl)-3-(1,2,4-triazol-1-yl)propane-1,2-diol CAS Name: 1,2-bis(4-methylphenyl)-3-(1,2,4-triazol-1-yl)propane-1,2-diol IUPAC Name: 1,2-bis(4-methylphenyl)-3-(1,2,4-triazol-1-yl)propane-1,2-diol Traditional Name: 1,2-bis(p-tolyl)-3-(1,2,4-triazol-1-yl)propane-1,2-diol Formula: C19H21N3O2 MolecularWeight: 323.38894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(CN2C=NC=N2)(C3=CC=C(C=C3)C)O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(C(CN2C=NC=N2)(C3=CC=C(C=C3)C)O)O

InChI

InChI=1S/C19H21N3O2/c1-14-3-7-16(8-4-14)18(23)19(24,11-22-13-20-12-21-22)17-9-5-15(2)6-10-17/h3-10,12-13,18,23-24H,11H2,1-2H3