6-bromanyl-2-(3-piperazin-1-ylpropyl)phthalazin-1-one

Systemtic Name: 6-bromanyl-2-(3-piperazin-1-ylpropyl)phthalazin-1-one Openeye Name: 6-bromo-2-(3-piperazin-1-ylpropyl)phthalazin-1-one CAS Name: 6-bromo-2-[3-(1-piperazinyl)propyl]-1-phthalazinone IUPAC Name: 6-bromo-2-(3-piperazin-1-ylpropyl)phthalazin-1-one Traditional Name: 6-bromo-2-(3-piperazinopropyl)phthalazin-1-one Formula: C15H19BrN4O MolecularWeight: 351.24156

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCCN2C(=O)C3=C(C=C(C=C3)Br)C=N2

Isomeric SMILES

C1CN(CCN1)CCCN2C(=O)C3=C(C=C(C=C3)Br)C=N2

InChI

InChI=1S/C15H19BrN4O/c16-13-2-3-14-12(10-13)11-18-20(15(14)21)7-1-6-19-8-4-17-5-9-19/h2-3,10-11,17H,1,4-9H2