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

Systemtic Name: 4-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one Openeye Name: 4-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxo-ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-oxoethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-2H-phthalazin-1-one Traditional Name: 4-[2-[4-(2,3-dimethylphenyl)piperazino]-2-keto-ethyl]-2H-phthalazin-1-one Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CC3=NNC(=O)C4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CC3=NNC(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C22H24N4O2/c1-15-6-5-9-20(16(15)2)25-10-12-26(13-11-25)21(27)14-19-17-7-3-4-8-18(17)22(28)24-23-19/h3-9H,10-14H2,1-2H3,(H,24,28)