4-[3-(hydroxymethyl)-4-methyl-phenyl]-2-methyl-phthalazin-1-one

Systemtic Name: 4-[3-(hydroxymethyl)-4-methyl-phenyl]-2-methyl-phthalazin-1-one Openeye Name: 4-[3-(hydroxymethyl)-4-methyl-phenyl]-2-methyl-phthalazin-1-one CAS Name: 4-[3-(hydroxymethyl)-4-methylphenyl]-2-methyl-1-phthalazinone IUPAC Name: 4-[3-(hydroxymethyl)-4-methylphenyl]-2-methylphthalazin-1-one Traditional Name: 2-methyl-4-(4-methyl-3-methylol-phenyl)phthalazin-1-one Formula: C17H16N2O2 MolecularWeight: 280.32114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C)CO

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C)CO

InChI

InChI=1S/C17H16N2O2/c1-11-7-8-12(9-13(11)10-20)16-14-5-3-4-6-15(14)17(21)19(2)18-16/h3-9,20H,10H2,1-2H3