N-[2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]ethyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide

Systemtic Name: N-[2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]ethyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide Openeye Name: N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-6-oxo-1-propyl-pyridazine-3-carboxamide CAS Name: N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-6-oxo-1-propyl-3-pyridazinecarboxamide IUPAC Name: N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-6-oxo-1-propylpyridazine-3-carboxamide Traditional Name: 6-keto-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-propyl-pyridazine-3-carboxamide Formula: C17H18F3N5O4 MolecularWeight: 413.35113

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)NCCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)NCCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H18F3N5O4/c1-2-9-24-15(26)6-5-13(23-24)16(27)22-8-7-21-12-4-3-11(17(18,19)20)10-14(12)25(28)29/h3-6,10,21H,2,7-9H2,1H3,(H,22,27)