6-chloranyl-3-(2-cyclopropyl-5-propan-2-yl-phenoxy)-1H-pyridazin-4-one

Systemtic Name: 6-chloranyl-3-(2-cyclopropyl-5-propan-2-yl-phenoxy)-1H-pyridazin-4-one Openeye Name: 6-chloro-3-(2-cyclopropyl-5-isopropyl-phenoxy)-1H-pyridazin-4-one CAS Name: 6-chloro-3-(2-cyclopropyl-5-propan-2-ylphenoxy)-1H-pyridazin-4-one IUPAC Name: 6-chloro-3-(2-cyclopropyl-5-propan-2-ylphenoxy)-1H-pyridazin-4-one Traditional Name: 6-chloro-3-(2-cyclopropyl-5-isopropyl-phenoxy)-1H-pyridazin-4-one Formula: C16H17ClN2O2 MolecularWeight: 304.77138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)C2CC2)OC3=NNC(=CC3=O)Cl

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)C2CC2)OC3=NNC(=CC3=O)Cl

InChI

InChI=1S/C16H17ClN2O2/c1-9(2)11-5-6-12(10-3-4-10)14(7-11)21-16-13(20)8-15(17)18-19-16/h5-10H,3-4H2,1-2H3,(H,18,20)