2-phenylsulfanylquinoline-5-carboxylic acid

Systemtic Name: 2-phenylsulfanylquinoline-5-carboxylic acid Openeye Name: 2-phenylsulfanylquinoline-5-carboxylic acid CAS Name: 2-(phenylthio)-5-quinolinecarboxylic acid IUPAC Name: 2-phenylsulfanylquinoline-5-carboxylic acid Traditional Name: 2-(phenylthio)quinoline-5-carboxylic acid Formula: C16H11NO2S MolecularWeight: 281.32904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=NC3=CC=CC(=C3C=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SC2=NC3=CC=CC(=C3C=C2)C(=O)O

InChI

InChI=1S/C16H11NO2S/c18-16(19)13-7-4-8-14-12(13)9-10-15(17-14)20-11-5-2-1-3-6-11/h1-10H,(H,18,19)