4-bromanyl-5-(4-ethylpiperazin-4-ium-1-yl)-2-phenyl-pyridazin-3-one

Systemtic Name: 4-bromanyl-5-(4-ethylpiperazin-4-ium-1-yl)-2-phenyl-pyridazin-3-one Openeye Name: 4-bromo-5-(4-ethylpiperazin-4-ium-1-yl)-2-phenyl-pyridazin-3-one CAS Name: 4-bromo-5-(4-ethyl-1-piperazin-4-iumyl)-2-phenyl-3-pyridazinone IUPAC Name: 4-bromo-5-(4-ethylpiperazin-4-ium-1-yl)-2-phenylpyridazin-3-one Traditional Name: 4-bromo-5-(4-ethylpiperazin-4-ium-1-yl)-2-phenyl-pyridazin-3-one Formula: C16H20BrN4O+ MolecularWeight: 364.2602

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Br

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Br

InChI

InChI=1S/C16H19BrN4O/c1-2-19-8-10-20(11-9-19)14-12-18-21(16(22)15(14)17)13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3/p+1