4-[4-(3-methoxyphenyl)piperazin-1-yl]carbonyl-2-(2-methylpropyl)phthalazin-1-one

Systemtic Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]carbonyl-2-(2-methylpropyl)phthalazin-1-one Openeye Name: 2-isobutyl-4-[4-(3-methoxyphenyl)piperazine-1-carbonyl]phthalazin-1-one CAS Name: 4-[[4-(3-methoxyphenyl)-1-piperazinyl]-oxomethyl]-2-(2-methylpropyl)-1-phthalazinone IUPAC Name: 4-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-2-(2-methylpropyl)phthalazin-1-one Traditional Name: 2-isobutyl-4-[4-(3-methoxyphenyl)piperazine-1-carbonyl]phthalazin-1-one Formula: C24H28N4O3 MolecularWeight: 420.50412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C24H28N4O3/c1-17(2)16-28-23(29)21-10-5-4-9-20(21)22(25-28)24(30)27-13-11-26(12-14-27)18-7-6-8-19(15-18)31-3/h4-10,15,17H,11-14,16H2,1-3H3