sodium 9-fluoranyl-3-(4-methylphenyl)-5H-isothiochromeno[4,3-b]quinoline-7-carboxylate

Systemtic Name: sodium 9-fluoranyl-3-(4-methylphenyl)-5H-isothiochromeno[4,3-b]quinoline-7-carboxylate Openeye Name: sodium 9-fluoro-3-(p-tolyl)-5H-isothiochromeno[4,3-b]quinoline-7-carboxylate CAS Name: sodium 9-fluoro-3-(4-methylphenyl)-5H-isothiochromeno[4,3-b]quinoline-7-carboxylate IUPAC Name: sodium 9-fluoro-3-(4-methylphenyl)-5H-isothiochromeno[4,3-b]quinoline-7-carboxylate Traditional Name: sodium 9-fluoro-3-(p-tolyl)-5H-isothiochromeno[4,3-b]quinoline-7-carboxylate Formula: C24H15FNNaO2S MolecularWeight: 423.434573

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)C4=C(C(=C5C=C(C=CC5=N4)F)C(=O)[O-])SC3.[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)C4=C(C(=C5C=C(C=CC5=N4)F)C(=O)[O-])SC3.[Na+]

InChI

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