4-butyl-5-[4-(trifluoromethyl)phenoxy]pyridazin-3-amine hydrochloride

Systemtic Name: 4-butyl-5-[4-(trifluoromethyl)phenoxy]pyridazin-3-amine hydrochloride Openeye Name: 4-butyl-5-[4-(trifluoromethyl)phenoxy]pyridazin-3-amine hydrochloride CAS Name: 4-butyl-5-[4-(trifluoromethyl)phenoxy]-3-pyridazinamine hydrochloride IUPAC Name: 4-butyl-5-[4-(trifluoromethyl)phenoxy]pyridazin-3-amine hydrochloride Traditional Name: [4-butyl-5-[4-(trifluoromethyl)phenoxy]pyridazin-3-yl]amine hydrochloride Formula: C15H17ClF3N3O MolecularWeight: 347.76319

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=NC=C1OC2=CC=C(C=C2)C(F)(F)F)N.Cl

Isomeric SMILES

CCCCC1=C(N=NC=C1OC2=CC=C(C=C2)C(F)(F)F)N.Cl

InChI

InChI=1S/C15H16F3N3O.ClH/c1-2-3-4-12-13(9-20-21-14(12)19)22-11-7-5-10(6-8-11)15(16,17)18;/h5-9H,2-4H2,1H3,(H2,19,21);1H