4-bromanyl-2-(3,3-dimethyl-2-oxidanylidene-butyl)-5-pyrrolidin-1-yl-pyridazin-3-one

Systemtic Name: 4-bromanyl-2-(3,3-dimethyl-2-oxidanylidene-butyl)-5-pyrrolidin-1-yl-pyridazin-3-one Openeye Name: 4-bromo-2-(3,3-dimethyl-2-oxo-butyl)-5-pyrrolidin-1-yl-pyridazin-3-one CAS Name: 4-bromo-2-(3,3-dimethyl-2-oxobutyl)-5-(1-pyrrolidinyl)-3-pyridazinone IUPAC Name: 4-bromo-2-(3,3-dimethyl-2-oxobutyl)-5-pyrrolidin-1-ylpyridazin-3-one Traditional Name: 4-bromo-2-(2-keto-3,3-dimethyl-butyl)-5-pyrrolidino-pyridazin-3-one Formula: C14H20BrN3O2 MolecularWeight: 342.2315

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C(=O)C(=C(C=N1)N2CCCC2)Br

Isomeric SMILES

CC(C)(C)C(=O)CN1C(=O)C(=C(C=N1)N2CCCC2)Br

InChI

InChI=1S/C14H20BrN3O2/c1-14(2,3)11(19)9-18-13(20)12(15)10(8-16-18)17-6-4-5-7-17/h8H,4-7,9H2,1-3H3