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Substance Name: 2-(2-(2,3-Dihydro-1,3-dioxo-1H-inden-2-yl)quinolin-6-yl)-6-methylbenzothiazole-7-sulphonic acid, compound with quinoline (1:1)
RN: 83949-93-3
InChIKey: SUKTYHWRJKAUHS-UHFFFAOYSA-N

Molecular Formula

  • C26-H16-N2-O5-S2.C9-H7-N

Molecular Weight

  • 629.7147
 
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Names and Synonyms

Synonym

  • EINECS 281-450-7

Systematic Name

  • 2-(2-(2,3-Dihydro-1,3-dioxo-1H-inden-2-yl)quinolin-6-yl)-6-methylbenzothiazole-7-sulphonic acid, compound with quinoline (1:1)

Registry Numbers

CAS Registry Number

  • 83949-93-3

System Generated Number

  • 0083949933

Molecular Formulas

Molecular Formula

  • C26-H16-N2-O5-S2.C9-H7-N

Molecular Formula Fragments

  • C26-H16-N2-O5-S2
  • C9-H7-N
  • COMPONENT

Structure Descriptors

InChI

1S/C26H16N2O5S2.C9H7N/c1-13-6-9-20-24(25(13)35(31,32)33)34-26(28-20)15-8-10-18-14(12-15)7-11-19(27-18)21-22(29)16-4-2-3-5-17(16)23(21)30;1-2-6-9-8(4-1)5-3-7-10-9/h2-12,21H,1H3,(H,31,32,33);1-7H

InChIKey

SUKTYHWRJKAUHS-UHFFFAOYSA-N

Smiles

Cc1ccc2c(c1S(=O)(=O)O)sc(n2)c3ccc4c(c3)ccc(n4)C5C(=O)c6ccccc6C5=O.c1ccc2c(c1)cccn2