4-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-2H-phthalazin-1-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=NNC(=O)C4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=NNC(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C21H22N4O2/c1-14-6-5-9-18(15(14)2)24-10-12-25(13-11-24)21(27)19-16-7-3-4-8-17(16)20(26)23-22-19/h3-9H,10-13H2,1-2H3,(H,23,26)