2-tert-butyl-4-chloranyl-5-(2-nitrophenoxy)pyridazin-3-one

Systemtic Name: 2-tert-butyl-4-chloranyl-5-(2-nitrophenoxy)pyridazin-3-one Openeye Name: 2-tert-butyl-4-chloro-5-(2-nitrophenoxy)pyridazin-3-one CAS Name: 2-tert-butyl-4-chloro-5-(2-nitrophenoxy)-3-pyridazinone IUPAC Name: 2-tert-butyl-4-chloro-5-(2-nitrophenoxy)pyridazin-3-one Traditional Name: 2-tert-butyl-4-chloro-5-(2-nitrophenoxy)pyridazin-3-one Formula: C14H14ClN3O4 MolecularWeight: 323.73166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=C(C=N1)OC2=CC=CC=C2[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(C=N1)OC2=CC=CC=C2[N+](=O)[O-])Cl

InChI

InChI=1S/C14H14ClN3O4/c1-14(2,3)17-13(19)12(15)11(8-16-17)22-10-7-5-4-6-9(10)18(20)21/h4-8H,1-3H3