4-[4-[(3-methylphenyl)methyl]piperazin-1-yl]carbonyl-2H-phthalazin-1-one

Systemtic Name: 4-[4-[(3-methylphenyl)methyl]piperazin-1-yl]carbonyl-2H-phthalazin-1-one Openeye Name: 4-[4-(m-tolylmethyl)piperazine-1-carbonyl]-2H-phthalazin-1-one CAS Name: 4-[[4-[(3-methylphenyl)methyl]-1-piperazinyl]-oxomethyl]-2H-phthalazin-1-one IUPAC Name: 4-[4-[(3-methylphenyl)methyl]piperazine-1-carbonyl]-2H-phthalazin-1-one Traditional Name: 4-[4-(3-methylbenzyl)piperazine-1-carbonyl]-2H-phthalazin-1-one Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H22N4O2/c1-15-5-4-6-16(13-15)14-24-9-11-25(12-10-24)21(27)19-17-7-2-3-8-18(17)20(26)23-22-19/h2-8,13H,9-12,14H2,1H3,(H,23,26)