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

Systemtic Name: 2-butyl-4-[4-(4-hydroxyphenyl)piperazin-1-yl]carbonyl-phthalazin-1-one Openeye Name: 2-butyl-4-[4-(4-hydroxyphenyl)piperazine-1-carbonyl]phthalazin-1-one CAS Name: 2-butyl-4-[[4-(4-hydroxyphenyl)-1-piperazinyl]-oxomethyl]-1-phthalazinone IUPAC Name: 2-butyl-4-[4-(4-hydroxyphenyl)piperazine-1-carbonyl]phthalazin-1-one Traditional Name: 2-butyl-4-[4-(4-hydroxyphenyl)piperazine-1-carbonyl]phthalazin-1-one Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O3/c1-2-3-12-27-22(29)20-7-5-4-6-19(20)21(24-27)23(30)26-15-13-25(14-16-26)17-8-10-18(28)11-9-17/h4-11,28H,2-3,12-16H2,1H3