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

Systemtic Name: disodium 6-(dimethylamino)-4-oxidanylidene-10-propyl-pyrano[3,2-g]quinoline-2,8-dicarboxylate Openeye Name: disodium 6-(dimethylamino)-4-oxo-10-propyl-pyrano[3,2-g]quinoline-2,8-dicarboxylate CAS Name: disodium 6-(dimethylamino)-4-oxo-10-propylpyrano[3,2-g]quinoline-2,8-dicarboxylate IUPAC Name: disodium 6-(dimethylamino)-4-oxo-10-propylpyrano[3,2-g]quinoline-2,8-dicarboxylate Traditional Name: disodium 6-(dimethylamino)-4-keto-10-propyl-pyrano[3,2-g]quinoline-2,8-dicarboxylate Formula: C19H16N2Na2O6 MolecularWeight: 414.31968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O6.2Na/c1-4-5-9-16-10(13(21(2)3)7-12(20-16)18(23)24)6-11-14(22)8-15(19(25)26)27-17(9)11;;/h6-8H,4-5H2,1-3H3,(H,23,24)(H,25,26);;/q;2*+1/p-2