8-prop-2-enylsulfanylquinoline-5-carboxylic acid

Systemtic Name: 8-prop-2-enylsulfanylquinoline-5-carboxylic acid Openeye Name: 8-allylsulfanylquinoline-5-carboxylic acid CAS Name: 8-(prop-2-enylthio)-5-quinolinecarboxylic acid IUPAC Name: 8-prop-2-enylsulfanylquinoline-5-carboxylic acid Traditional Name: 8-(allylthio)quinoline-5-carboxylic acid Formula: C13H11NO2S MolecularWeight: 245.29694

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=C2C(=C(C=C1)C(=O)O)C=CC=N2

Isomeric SMILES

C=CCSC1=C2C(=C(C=C1)C(=O)O)C=CC=N2

InChI

InChI=1S/C13H11NO2S/c1-2-8-17-11-6-5-10(13(15)16)9-4-3-7-14-12(9)11/h2-7H,1,8H2,(H,15,16)