Chem
J-GLOBAL ID：200907003442382572   Nikkaji number：J2.727.719E

5,5-Dimethyl-7α-butyl-9-phenyl-6,8,10-trioxo-1,4,4aα,5,6,9,10,10bβ-octahydro-7H,8H-7a,9,10a-triazacyclohepta[cd]-s-indacene-2,4β-dicarboxylic acid dimethyl ester

5,5-ジメチル-7α-ブチル-9-フェニル-6,8,10-トリオキソ-1,4,4aα,5,6,9,10,10bβ-オクタヒドロ-7H,8H-7a,9,10a-トリアザシクロヘプタ[cd]-s-インダセン-2,4β-ジカルボン酸ジメチル
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： C29H33N3O7
Molecular formula furigana： C29-H33-N3-O7
Molecular weight： 535.597
InChI： InChI=1S/C29H33N3O7/c1-6-7-13-19-22-21-20(32-28(37)30(27(36)31(19)32)17-11-9-8-10-12-17)15-16(25(34)38-4)14-18(26(35)39-5)23(21)29(2,3)24(22)33/h8-12,14,18-20,23H,6-7,13,15H2,1-5H3/t18-,19+,20-,23-/m1/s1
InChI key： SGLQLAKPVULPCZ-VLVHOKLOSA-N
SMILES： CCCC[C@H]1C2=C3[C@@H]([C@@H](C=C(C[C@H]3n3n1c(=O)n(c1ccccc1)c3=O)C(=O)OC)C(=O)OC)C(C)(C)C2=O
Systematic name  (3)：
  • 5,5-ジメチル-7α-ブチル-9-フェニル-6,8,10-トリオキソ-1,4,4aα,5,6,9,10,10bβ-オクタヒドロ-7H,8H-7a,9,10a-トリアザシクロヘプタ[cd]-s-インダセン-2,4β-ジカルボン酸ジメチル
  • 5,7-ジメチル (4R,5R,9R,15S)-15-ブチル-3,3-ジメチル-2,11,13-トリオキソ-12-フェニル-10,12,14-トリアザテトラシクロ[7.6.1.04,16.010,14]ヘキサデカ-1(16),6-ジエン-5,7-ジカルボキシラート
  • 5,7-dimethyl (4R,5R,9R,15S)-15-butyl-3,3-dimethyl-2,11,13-trioxo-12-phenyl-10,12,14-triazatetracyclo[7.6.1.04,16.010,14]hexadeca-1(16),6-diene-5,7-dicarboxylate
Other name (1)：
  • 5,5-Dimethyl-7α-butyl-9-phenyl-6,8,10-trioxo-1,4,4aα,5,6,9,10,10bβ-octahydro-7H,8H-7a,9,10a-triazacyclohepta[cd]-s-indacene-2,4β-dicarboxylic acid dimethyl ester
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM