8-[3-(4-oxidanyloxan-4-yl)phenyl]sulfanyl-5-phenyl-imidazo[1,2-a]quinoline-2-carboxylic acid

Systemtic Name: 8-[3-(4-oxidanyloxan-4-yl)phenyl]sulfanyl-5-phenyl-imidazo[1,2-a]quinoline-2-carboxylic acid Openeye Name: 8-[3-(4-hydroxytetrahydropyran-4-yl)phenyl]sulfanyl-5-phenyl-imidazo[1,2-a]quinoline-2-carboxylic acid CAS Name: 8-[[3-(4-hydroxy-4-oxanyl)phenyl]thio]-5-phenyl-2-imidazo[1,2-a]quinolinecarboxylic acid IUPAC Name: 8-[3-(4-hydroxyoxan-4-yl)phenyl]sulfanyl-5-phenylimidazo[1,2-a]quinoline-2-carboxylic acid Traditional Name: 8-[[3-(4-hydroxytetrahydropyran-4-yl)phenyl]thio]-5-phenyl-imidazo[1,2-a]quinoline-2-carboxylic acid Formula: C29H24N2O4S MolecularWeight: 496.57686

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C2=CC(=CC=C2)SC3=CC4=C(C=C3)C(=CC5=NC(=CN45)C(=O)O)C6=CC=CC=C6)O

Isomeric SMILES

C1COCCC1(C2=CC(=CC=C2)SC3=CC4=C(C=C3)C(=CC5=NC(=CN45)C(=O)O)C6=CC=CC=C6)O

InChI

InChI=1S/C29H24N2O4S/c32-28(33)25-18-31-26-16-22(36-21-8-4-7-20(15-21)29(34)11-13-35-14-12-29)9-10-23(26)24(17-27(31)30-25)19-5-2-1-3-6-19/h1-10,15-18,34H,11-14H2,(H,32,33)