sodium 9-fluoranyl-3-(2-methylphenyl)-6H-thiochromeno[4,3-b]quinoline-7-carboxylate

Systemtic Name: sodium 9-fluoranyl-3-(2-methylphenyl)-6H-thiochromeno[4,3-b]quinoline-7-carboxylate Openeye Name: sodium 9-fluoro-3-(o-tolyl)-6H-thiochromeno[4,3-b]quinoline-7-carboxylate CAS Name: sodium 9-fluoro-3-(2-methylphenyl)-6H-thiochromeno[4,3-b]quinoline-7-carboxylate IUPAC Name: sodium 9-fluoro-3-(2-methylphenyl)-6H-thiochromeno[4,3-b]quinoline-7-carboxylate Traditional Name: sodium 9-fluoro-3-(o-tolyl)-6H-thiochromeno[4,3-b]quinoline-7-carboxylate Formula: C24H15FNNaO2S MolecularWeight: 423.434573

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC3=C(C=C2)C4=C(CS3)C(=C5C=C(C=CC5=N4)F)C(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC=CC=C1C2=CC3=C(C=C2)C4=C(CS3)C(=C5C=C(C=CC5=N4)F)C(=O)[O-].[Na+]

InChI

InChI=1S/C24H16FNO2S.Na/c1-13-4-2-3-5-16(13)14-6-8-17-21(10-14)29-12-19-22(24(27)28)18-11-15(25)7-9-20(18)26-23(17)19;/h2-11H,12H2,1H3,(H,27,28);/q;+1/p-1