2-azanylpropane-1,3-diol; 4-methyl-6-(4-methylphenyl)-2-(2-methylpropyl)pyridazin-3-one

Systemtic Name: 2-azanylpropane-1,3-diol; 4-methyl-6-(4-methylphenyl)-2-(2-methylpropyl)pyridazin-3-one Openeye Name: 2-aminopropane-1,3-diol; 2-isobutyl-4-methyl-6-(p-tolyl)pyridazin-3-one CAS Name: 2-aminopropane-1,3-diol; 4-methyl-6-(4-methylphenyl)-2-(2-methylpropyl)-3-pyridazinone IUPAC Name: 2-aminopropane-1,3-diol; 4-methyl-6-(4-methylphenyl)-2-(2-methylpropyl)pyridazin-3-one Traditional Name: 2-aminopropane-1,3-diol; 2-isobutyl-4-methyl-6-(p-tolyl)pyridazin-3-one Formula: C19H29N3O3 MolecularWeight: 347.45186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C(=C2)C)CC(C)C.C(C(CO)N)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C(=C2)C)CC(C)C.C(C(CO)N)O

InChI

InChI=1S/C16H20N2O.C3H9NO2/c1-11(2)10-18-16(19)13(4)9-15(17-18)14-7-5-12(3)6-8-14;4-3(1-5)2-6/h5-9,11H,10H2,1-4H3;3,5-6H,1-2,4H2