3-[4-[(2-oxidanylcyclohexyl)amino]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one

Systemtic Name: 3-[4-[(2-oxidanylcyclohexyl)amino]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Openeye Name: 3-[4-[(2-hydroxycyclohexyl)amino]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one CAS Name: 3-[4-[(2-hydroxycyclohexyl)amino]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-[(2-hydroxycyclohexyl)amino]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Traditional Name: 3-[4-[(2-hydroxycyclohexyl)amino]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Formula: C17H18F3N3O2 MolecularWeight: 353.33893

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)NC2=C(C=C(C=C2)C3=NNC(=O)C=C3)C(F)(F)F)O

Isomeric SMILES

C1CCC(C(C1)NC2=C(C=C(C=C2)C3=NNC(=O)C=C3)C(F)(F)F)O

InChI

InChI=1S/C17H18F3N3O2/c18-17(19,20)11-9-10(12-7-8-16(25)23-22-12)5-6-13(11)21-14-3-1-2-4-15(14)24/h5-9,14-15,21,24H,1-4H2,(H,23,25)