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

Systemtic Name: 2-butyl-4-[4-(3-methoxyphenyl)piperazin-1-yl]carbonyl-phthalazin-1-one Openeye Name: 2-butyl-4-[4-(3-methoxyphenyl)piperazine-1-carbonyl]phthalazin-1-one CAS Name: 2-butyl-4-[[4-(3-methoxyphenyl)-1-piperazinyl]-oxomethyl]-1-phthalazinone IUPAC Name: 2-butyl-4-[4-(3-methoxyphenyl)piperazine-1-carbonyl]phthalazin-1-one Traditional Name: 2-butyl-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:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C24H28N4O3/c1-3-4-12-28-23(29)21-11-6-5-10-20(21)22(25-28)24(30)27-15-13-26(14-16-27)18-8-7-9-19(17-18)31-2/h5-11,17H,3-4,12-16H2,1-2H3