4-[4-(2-dimethylaminoethyl)piperazin-1-yl]carbonyl-2-methyl-phthalazin-1-one

Systemtic Name: 4-[4-(2-dimethylaminoethyl)piperazin-1-yl]carbonyl-2-methyl-phthalazin-1-one Openeye Name: 4-[4-(2-dimethylaminoethyl)piperazine-1-carbonyl]-2-methyl-phthalazin-1-one CAS Name: 4-[[4-(2-dimethylaminoethyl)-1-piperazinyl]-oxomethyl]-2-methyl-1-phthalazinone IUPAC Name: 4-[4-(2-dimethylaminoethyl)piperazine-1-carbonyl]-2-methylphthalazin-1-one Traditional Name: 4-[4-(2-dimethylaminoethyl)piperazine-1-carbonyl]-2-methyl-phthalazin-1-one Formula: C18H25N5O2 MolecularWeight: 343.4234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)CCN(C)C

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)CCN(C)C

InChI

InChI=1S/C18H25N5O2/c1-20(2)8-9-22-10-12-23(13-11-22)18(25)16-14-6-4-5-7-15(14)17(24)21(3)19-16/h4-7H,8-13H2,1-3H3