Chem
J-GLOBAL ID:200907027363461021
Nikkaji number:J1.082.853H
10,11-Diphenyltetracyclo[6.4.0.04,12 .05,9 ]dodecane-10-ene-9,12-dicarboxylic acid dimethyl ester
10,11-ジフェニルテトラシクロ[6.4.0.04,12 .05,9 ]ドデカン-10-エン-9,12-ジカルボン酸ジメチル
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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:
C28 H28 O4
Molecular formula furigana:
C28-H28-O4
Molecular weight:
428.528
InChI:
InChI=1S/C28H28O4/c1-31-25(29)27-19-13-14-20(27)22-16-15-21(19)28(22,26(30)32-2)24(18-11-7-4-8-12-18)23(27)17-9-5-3-6-10-17/h3-12,19-22H,13-16H2,1-2H3
InChI key:
IWXBNVQVGQXAGW-UHFFFAOYSA-N
SMILES:
COC(=O)C12C3CCC1C1CCC3C1(C(=O)OC)C(=C2c1ccccc1)c1ccccc1
Systematic name (3):
10,11-ジフェニルテトラシクロ[6.4.0.04,12 .05,9 ]ドデカン-10-エン-9,12-ジカルボン酸ジメチル
9,12-ジメチル 10,11-ジフェニルテトラシクロ[6.4.0.04,12 .05,9 ]ドデカ-10-エン-9,12-ジカルボキシラート
9,12-dimethyl 10,11-diphenyltetracyclo[6.4.0.04,12 .05,9 ]dodec-10-ene-9,12-dicarboxylate
Other name (1):
10,11-Diphenyltetracyclo[6.4.0.04,12 .05,9 ]dodecane-10-ene-9,12-dicarboxylic acid dimethyl ester
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