4-[(Z)-[1-[2-chloranyl-5-(trifluoromethyl)phenyl]-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]-2-nitro-phenolate

Systemtic Name: 4-[(Z)-[1-[2-chloranyl-5-(trifluoromethyl)phenyl]-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]-2-nitro-phenolate Openeye Name: 4-[(Z)-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2,4,6-trioxo-hexahydropyrimidin-5-ylidene]methyl]-2-nitro-phenolate CAS Name: 4-[(Z)-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]-2-nitrophenolate IUPAC Name: 4-[(Z)-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]-2-nitrophenolate Traditional Name: 4-[(Z)-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2,4,6-triketo-hexahydropyrimidin-5-ylidene]methyl]-2-nitro-phenolate Formula: C18H8ClF3N3O6- MolecularWeight: 454.72083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=C2C(=O)NC(=O)N(C2=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC(=C(C=C1/C=C\2/C(=O)NC(=O)N(C2=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)[N+](=O)[O-])[O-]

InChI

InChI=1S/C18H9ClF3N3O6/c19-11-3-2-9(18(20,21)22)7-12(11)24-16(28)10(15(27)23-17(24)29)5-8-1-4-14(26)13(6-8)25(30)31/h1-7,26H,(H,23,27,29)/p-1/b10-5-