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

Systemtic Name: disodium 6-(methylamino)-4-oxidanylidene-10-propyl-pyrano[3,2-g]quinoline-2,8-dicarboxylate Openeye Name: disodium 6-(methylamino)-4-oxo-10-propyl-pyrano[3,2-g]quinoline-2,8-dicarboxylate CAS Name: disodium 6-(methylamino)-4-oxo-10-propylpyrano[3,2-g]quinoline-2,8-dicarboxylate IUPAC Name: disodium 6-(methylamino)-4-oxo-10-propylpyrano[3,2-g]quinoline-2,8-dicarboxylate Traditional Name: disodium 4-keto-6-(methylamino)-10-propyl-pyrano[3,2-g]quinoline-2,8-dicarboxylate Formula: C18H14N2Na2O6 MolecularWeight: 400.2931

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-])NC.[Na+].[Na+]

Isomeric SMILES

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

InChI

InChI=1S/C18H16N2O6.2Na/c1-3-4-8-15-9(11(19-2)6-12(20-15)17(22)23)5-10-13(21)7-14(18(24)25)26-16(8)10;;/h5-7H,3-4H2,1-2H3,(H,19,20)(H,22,23)(H,24,25);;/q;2*+1/p-2