Chem
J-GLOBAL ID：201707018818407733   Nikkaji number：J3.579.440I

3-Nitro-17,18-dibromo-5,10,15-tris(4-methylphenyl)corrole

3-ニトロ-17,18-ジブロモ-5,10,15-トリス(4-メチルフェニル)コロール
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： C40H29Br2N4[N+]O[O-]
Molecular formula furigana： C40-H29-BR2-N5-O2
Molecular weight： 771.513
InChI： InChI=1S/C40H29Br2N5O2/c1-21-4-10-24(11-5-21)33-27-16-18-29(43-27)34(25-12-6-22(2)7-13-25)39-32(47(48)49)20-31(45-39)38-36(41)37(42)40(46-38)35(30-19-17-28(33)44-30)26-14-8-23(3)9-15-26/h4-20,43-45H,1-3H3/b33-27-,33-28-,34-29-,35-30-,38-31-,39-34-,40-35-
InChI key： QXNBLBIKQHIKBK-KAVKYOQRSA-N
SMILES： Cc1ccc(cc1)/C/1=c/2\cc/c(=C(/c3c(cc(C4=N/C(=C(\c5ccc1[nH]5)/c1ccc(C)cc1)/C(=C4Br)Br)[nH]3)[N+](=O)[O-])\c1ccc(C)cc1)/[nH]2
Systematic name  (3)：
  • 3-ニトロ-17,18-ジブロモ-5,10,15-トリス(4-メチルフェニル)コロール
  • 18,19-ジブロモ-6,11,16-トリス(4-メチルフェニル)-4-ニトロ-20,21,22,23-テトラアザペンタシクロ[15.2.1.12,5.17,10.112,15]トリコサ-1(20),2,4,6,8,10,12,14,16,18-デカエン
  • 18,19-dibromo-6,11,16-tris(4-methylphenyl)-4-nitro-20,21,22,23-tetraazapentacyclo[15.2.1.12,5.17,10.112,15]tricosa-1(20),2,4,6,8,10,12,14,16,18-decaene
Other name (1)：
  • 3-Nitro-17,18-dibromo-5,10,15-tris(4-methylphenyl)corrole
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM