5-bromanyl-4-(4-cyclopentylpiperazin-4-ium-1-yl)-1H-pyridazin-6-one

Systemtic Name: 5-bromanyl-4-(4-cyclopentylpiperazin-4-ium-1-yl)-1H-pyridazin-6-one Openeye Name: 5-bromo-4-(4-cyclopentylpiperazin-4-ium-1-yl)-1H-pyridazin-6-one CAS Name: 5-bromo-4-(4-cyclopentyl-1-piperazin-4-iumyl)-1H-pyridazin-6-one IUPAC Name: 5-bromo-4-(4-cyclopentylpiperazin-4-ium-1-yl)-1H-pyridazin-6-one Traditional Name: 5-bromo-4-(4-cyclopentylpiperazin-4-ium-1-yl)-1H-pyridazin-6-one Formula: C13H20BrN4O+ MolecularWeight: 328.2281

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN(CC2)C3=C(C(=O)NN=C3)Br

Isomeric SMILES

C1CCC(C1)[NH+]2CCN(CC2)C3=C(C(=O)NN=C3)Br

InChI

InChI=1S/C13H19BrN4O/c14-12-11(9-15-16-13(12)19)18-7-5-17(6-8-18)10-3-1-2-4-10/h9-10H,1-8H2,(H,16,19)/p+1