N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide

Systemtic Name: N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide Openeye Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-6-oxo-1-propyl-pyridazine-3-carboxamide CAS Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-6-oxo-1-propyl-3-pyridazinecarboxamide IUPAC Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-6-oxo-1-propylpyridazine-3-carboxamide Traditional Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-6-keto-1-propyl-pyridazine-3-carboxamide Formula: C16H18N4O5 MolecularWeight: 346.33792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C16H18N4O5/c1-2-9-19-15(22)8-7-13(18-19)16(23)17-10-14(21)11-3-5-12(6-4-11)20(24)25/h3-8,14,21H,2,9-10H2,1H3,(H,17,23)