2-[[(4-dimethylaminophenyl)methyl-methyl-amino]methyl]-4-(2,5-dimethylphenyl)phthalazin-1-one

Systemtic Name: 2-[[(4-dimethylaminophenyl)methyl-methyl-amino]methyl]-4-(2,5-dimethylphenyl)phthalazin-1-one Openeye Name: 2-[[(4-dimethylaminophenyl)methyl-methyl-amino]methyl]-4-(2,5-dimethylphenyl)phthalazin-1-one CAS Name: 2-[[(4-dimethylaminophenyl)methyl-methylamino]methyl]-4-(2,5-dimethylphenyl)-1-phthalazinone IUPAC Name: 2-[[(4-dimethylaminophenyl)methyl-methylamino]methyl]-4-(2,5-dimethylphenyl)phthalazin-1-one Traditional Name: 2-[[[4-(dimethylamino)benzyl]-methyl-amino]methyl]-4-(2,5-dimethylphenyl)phthalazin-1-one Formula: C27H30N4O MolecularWeight: 426.5533

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C3=CC=CC=C32)CN(C)CC4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C3=CC=CC=C32)CN(C)CC4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C27H30N4O/c1-19-10-11-20(2)25(16-19)26-23-8-6-7-9-24(23)27(32)31(28-26)18-30(5)17-21-12-14-22(15-13-21)29(3)4/h6-16H,17-18H2,1-5H3