4-chloranyl-5-(4-ethylpiperazin-4-ium-1-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]pyridazin-3-one

Systemtic Name: 4-chloranyl-5-(4-ethylpiperazin-4-ium-1-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]pyridazin-3-one Openeye Name: 4-chloro-5-(4-ethylpiperazin-4-ium-1-yl)-2-[5-(trifluoromethyl)-2-pyridyl]pyridazin-3-one CAS Name: 4-chloro-5-(4-ethyl-1-piperazin-4-iumyl)-2-[5-(trifluoromethyl)-2-pyridinyl]-3-pyridazinone IUPAC Name: 4-chloro-5-(4-ethylpiperazin-4-ium-1-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]pyridazin-3-one Traditional Name: 4-chloro-5-(4-ethylpiperazin-4-ium-1-yl)-2-[5-(trifluoromethyl)-2-pyridyl]pyridazin-3-one Formula: C16H18ClF3N5O+ MolecularWeight: 388.79523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17ClF3N5O/c1-2-23-5-7-24(8-6-23)12-10-22-25(15(26)14(12)17)13-4-3-11(9-21-13)16(18,19)20/h3-4,9-10H,2,5-8H2,1H3/p+1