4-(4-methylphenyl)-2-[(4-methylpiperidin-1-yl)methyl]phthalazin-1-one

Systemtic Name: 4-(4-methylphenyl)-2-[(4-methylpiperidin-1-yl)methyl]phthalazin-1-one Openeye Name: 2-[(4-methyl-1-piperidyl)methyl]-4-(p-tolyl)phthalazin-1-one CAS Name: 4-(4-methylphenyl)-2-[(4-methyl-1-piperidinyl)methyl]-1-phthalazinone IUPAC Name: 4-(4-methylphenyl)-2-[(4-methylpiperidin-1-yl)methyl]phthalazin-1-one Traditional Name: 2-[(4-methylpiperidino)methyl]-4-(p-tolyl)phthalazin-1-one Formula: C22H25N3O MolecularWeight: 347.4534

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)C

Isomeric SMILES

CC1CCN(CC1)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)C

InChI

InChI=1S/C22H25N3O/c1-16-7-9-18(10-8-16)21-19-5-3-4-6-20(19)22(26)25(23-21)15-24-13-11-17(2)12-14-24/h3-10,17H,11-15H2,1-2H3