disodium 4-oxidanylidene-10-propyl-6-(trifluoromethyl)pyrano[3,2-g]quinoline-2,8-dicarboxylate

Systemtic Name: disodium 4-oxidanylidene-10-propyl-6-(trifluoromethyl)pyrano[3,2-g]quinoline-2,8-dicarboxylate Openeye Name: disodium 4-oxo-10-propyl-6-(trifluoromethyl)pyrano[3,2-g]quinoline-2,8-dicarboxylate CAS Name: disodium 4-oxo-10-propyl-6-(trifluoromethyl)pyrano[3,2-g]quinoline-2,8-dicarboxylate IUPAC Name: disodium 4-oxo-10-propyl-6-(trifluoromethyl)pyrano[3,2-g]quinoline-2,8-dicarboxylate Traditional Name: disodium 4-keto-10-propyl-6-(trifluoromethyl)pyrano[3,2-g]quinoline-2,8-dicarboxylate Formula: C18H10F3NNa2O6 MolecularWeight: 439.24985

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC3=C1OC(=CC3=O)C(=O)[O-])C(=CC(=N2)C(=O)[O-])C(F)(F)F.[Na+].[Na+]

Isomeric SMILES

CCCC1=C2C(=CC3=C1OC(=CC3=O)C(=O)[O-])C(=CC(=N2)C(=O)[O-])C(F)(F)F.[Na+].[Na+]

InChI

InChI=1S/C18H12F3NO6.2Na/c1-2-3-7-14-8(10(18(19,20)21)5-11(22-14)16(24)25)4-9-12(23)6-13(17(26)27)28-15(7)9;;/h4-6H,2-3H2,1H3,(H,24,25)(H,26,27);;/q;2*+1/p-2