4-[3-(dimethylamino)-2-oxidanyl-propoxy]-2H-phthalazin-1-one

Systemtic Name: 4-[3-(dimethylamino)-2-oxidanyl-propoxy]-2H-phthalazin-1-one Openeye Name: 4-[3-(dimethylamino)-2-hydroxy-propoxy]-2H-phthalazin-1-one CAS Name: 4-[3-(dimethylamino)-2-hydroxypropoxy]-2H-phthalazin-1-one IUPAC Name: 4-[3-(dimethylamino)-2-hydroxypropoxy]-2H-phthalazin-1-one Traditional Name: 4-[3-(dimethylamino)-2-hydroxy-propoxy]-2H-phthalazin-1-one Formula: C13H17N3O3 MolecularWeight: 263.29238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(COC1=NNC(=O)C2=CC=CC=C21)O

Isomeric SMILES

CN(C)CC(COC1=NNC(=O)C2=CC=CC=C21)O

InChI

InChI=1S/C13H17N3O3/c1-16(2)7-9(17)8-19-13-11-6-4-3-5-10(11)12(18)14-15-13/h3-6,9,17H,7-8H2,1-2H3,(H,14,18)