Chem
J-GLOBAL ID：200907024904757922   Nikkaji number：J295.181I

2-[[(1-Benzoyl-2,7-dihydro-4-methyl-2,7-dioxo-3H-dibenz[f,ij]isoquinolin)-6-yl]amino]-5-methylbenzenesulfonic acid sodium salt

2-[[(1-ベンゾイル-2,7-ジヒドロ-4-メチル-2,7-ジオキソ-3H-ジベンゾ[f,ij]イソキノリン)-6-イル]アミノ]-5-メチルベンゼンスルホン酸ナトリウム
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C31H21N2NaO6S
Molecular formula furigana： C31-H21-N2-NA-O6-S
Molecular weight： 572.570
InChI： InChI=1S/C31H22N2O6S.Na/c1-16-12-13-21(23(14-16)40(37,38)39)32-22-15-17(2)28-26-24(19-10-6-7-11-20(19)30(35)25(22)26)27(31(36)33-28)29(34)18-8-4-3-5-9-18;/h3-15,32H,1-2H3,(H,33,36)(H,37,38,39);/q;+1/p-1
InChI key： PMPJHLRSBZONMN-UHFFFAOYSA-M
SMILES： Cc1ccc(Nc2cc(C)c3[nH]c(=O)c(C(=O)c4ccccc4)c4c5ccccc5c(=O)c2c34)c(c1)S(=O)(=O)O[Na]
Systematic name  (3)：
  • 2-[[(1-ベンゾイル-2,7-ジヒドロ-4-メチル-2,7-ジオキソ-3H-ジベンゾ[f,ij]イソキノリン)-6-イル]アミノ]-5-メチルベンゼンスルホン酸ナトリウム
  • ナトリウム 2-({16-ベンゾイル-12-メチル-8,15-ジオキソ-14-アザテトラシクロ[7.7.1.02,7.013,17]ヘプタデカ-1(16),2,4,6,9(17),10,12-ヘプタエン-10-イル}アミノ)-5-メチルベンゼン-1-スルホナート
  • sodium 2-({16-benzoyl-12-methyl-8,15-dioxo-14-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12-heptaen-10-yl}amino)-5-methylbenzene-1-sulfonate
Other name (1)：
  • 2-[[(1-Benzoyl-2,7-dihydro-4-methyl-2,7-dioxo-3H-dibenz[f,ij]isoquinolin)-6-yl]amino]-5-methylbenzenesulfonic acid sodium salt
CAS registry number： 72152-48-8
Regulation number (2)：
  • EINECS2764027
  • TSCA(72152-48-8)
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM