2-butyl-4-(4-phenylpiperazin-1-yl)carbonyl-phthalazin-1-one

Systemtic Name: 2-butyl-4-(4-phenylpiperazin-1-yl)carbonyl-phthalazin-1-one Openeye Name: 2-butyl-4-(4-phenylpiperazine-1-carbonyl)phthalazin-1-one CAS Name: 2-butyl-4-[oxo-(4-phenyl-1-piperazinyl)methyl]-1-phthalazinone IUPAC Name: 2-butyl-4-(4-phenylpiperazine-1-carbonyl)phthalazin-1-one Traditional Name: 2-butyl-4-(4-phenylpiperazine-1-carbonyl)phthalazin-1-one Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O2/c1-2-3-13-27-22(28)20-12-8-7-11-19(20)21(24-27)23(29)26-16-14-25(15-17-26)18-9-5-4-6-10-18/h4-12H,2-3,13-17H2,1H3