8-oxidanyl-7-tetradecylsulfanyl-quinoline-5,6-dione

Systemtic Name: 8-oxidanyl-7-tetradecylsulfanyl-quinoline-5,6-dione Openeye Name: 8-hydroxy-7-tetradecylsulfanyl-quinoline-5,6-dione CAS Name: 8-hydroxy-7-(tetradecylthio)quinoline-5,6-dione IUPAC Name: 8-hydroxy-7-tetradecylsulfanylquinoline-5,6-dione Traditional Name: 8-hydroxy-7-(myristylthio)quinoline-5,6-quinone Formula: C23H33NO3S MolecularWeight: 403.57802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCSC1=C(C2=C(C=CC=N2)C(=O)C1=O)O

Isomeric SMILES

CCCCCCCCCCCCCCSC1=C(C2=C(C=CC=N2)C(=O)C1=O)O

InChI

InChI=1S/C23H33NO3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-28-23-21(26)19-18(15-14-16-24-19)20(25)22(23)27/h14-16,26H,2-13,17H2,1H3