4-[4-(2-phenoxyethyl)piperazin-1-yl]carbonyl-2-propan-2-yl-phthalazin-1-one

Systemtic Name: 4-[4-(2-phenoxyethyl)piperazin-1-yl]carbonyl-2-propan-2-yl-phthalazin-1-one Openeye Name: 2-isopropyl-4-[4-(2-phenoxyethyl)piperazine-1-carbonyl]phthalazin-1-one CAS Name: 4-[oxo-[4-(2-phenoxyethyl)-1-piperazinyl]methyl]-2-propan-2-yl-1-phthalazinone IUPAC Name: 4-[4-(2-phenoxyethyl)piperazine-1-carbonyl]-2-propan-2-ylphthalazin-1-one Traditional Name: 2-isopropyl-4-[4-(2-phenoxyethyl)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)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)CCOC4=CC=CC=C4

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O3/c1-18(2)28-23(29)21-11-7-6-10-20(21)22(25-28)24(30)27-14-12-26(13-15-27)16-17-31-19-8-4-3-5-9-19/h3-11,18H,12-17H2,1-2H3