Chem
J-GLOBAL ID：201107018468644791   Nikkaji number：J2.921.102G

5,9,11,12-Tetrahydro-5-methyl-6-[3-(trifluoromethyl)phenyl]-12,13-diphenyl-10,11-(epoxymetheno)benzo[5,6]cyclohepta[1,2-b]indole-8,8(7H)-dicarboxylic acid dimethyl ester

5,9,11,12-テトラヒドロ-5-メチル-6-[3-(トリフルオロメチル)フェニル]-12,13-ジフェニル-10,11-(エポキシメテノ)ベンゾ[5,6]シクロヘプタ[1,2-b]インドール-8,8(7H)-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： C42H32F3NO5
Molecular formula furigana： C42-H32-F3-N-O5
Molecular weight： 687.715
InChI： InChI=1S/C42H32F3NO5/c1-46-30-20-11-10-19-28(30)35-33(24-13-6-4-7-14-24)36-34-29(32(37(35)46)26-17-12-18-27(21-26)42(43,44)45)22-41(39(47)49-2,40(48)50-3)23-31(34)51-38(36)25-15-8-5-9-16-25/h4-21,33H,22-23H2,1-3H3
InChI key： XWRPYKJRNAWMTI-UHFFFAOYSA-N
SMILES： COC(=O)C1(Cc2oc(c3C(c4c(C(=C(C1)c23)c1cccc(c1)C(F)(F)F)n(C)c1ccccc41)c1ccccc1)c1ccccc1)C(=O)OC
Systematic name  (3)：
  • 5,9,11,12-テトラヒドロ-5-メチル-6-[3-(トリフルオロメチル)フェニル]-12,13-ジフェニル-10,11-(エポキシメテノ)ベンゾ[5,6]シクロヘプタ[1,2-b]インドール-8,8(7H)-ジカルボン酸ジメチル
  • 15,15-ジメチル 10-メチル-2,19-ジフェニル-12-[3-(トリフルオロメチル)フェニル]-18-オキサ-10-アザペンタシクロ[11.6.1.03,11.04,9.017,20]イコサ-1(19),3(11),4,6,8,12,17(20)-ヘプタエン-15,15-ジカルボキシラート
  • 15,15-dimethyl 10-methyl-2,19-diphenyl-12-[3-(trifluoromethyl)phenyl]-18-oxa-10-azapentacyclo[11.6.1.03,11.04,9.017,20]icosa-1(19),3(11),4,6,8,12,17(20)-heptaene-15,15-dicarboxylate
Other name (1)：
  • 5,9,11,12-Tetrahydro-5-methyl-6-[3-(trifluoromethyl)phenyl]-12,13-diphenyl-10,11-(epoxymetheno)benzo[5,6]cyclohepta[1,2-b]indole-8,8(7H)-dicarboxylic acid dimethyl ester
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