Chem
J-GLOBAL ID:201707007972684390
Nikkaji number:J3.637.470E
1-(4-Isopropoxyphenyl)-5-(4-tert-butylphenyl)-1H-indole-2-carboxylic acid
1-(4-イソプロポキシフェニル)-5-(4-tert-ブチルフェニル)-1H-インドール-2-カルボン酸
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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 H29 NO3
Molecular formula furigana:
C28-H29-N-O3
Molecular weight:
427.544
InChI:
InChI=1S/C28H29NO3/c1-18(2)32-24-13-11-23(12-14-24)29-25-15-8-20(16-21(25)17-26(29)27(30)31)19-6-9-22(10-7-19)28(3,4)5/h6-18H,1-5H3,(H,30,31)
InChI key:
GUMCVDVWBMLUSQ-UHFFFAOYSA-N
SMILES:
CC(C)Oc1ccc(cc1)n1c(cc2cc(ccc12)c1ccc(cc1)C(C)(C)C)C(=O)O
Systematic name (3):
1-(4-イソプロポキシフェニル)-5-(4-tert-ブチルフェニル)-1H-インドール-2-カルボン酸
5-(4-tert-ブチルフェニル)-1-[4-(プロパン-2-イルオキシ)フェニル]-1H-インドール-2-カルボン酸
5-(4-tert-butylphenyl)-1-[4-(propan-2-yloxy)phenyl]-1H-indole-2-carboxylic acid
Other name (1):
1-(4-Isopropoxyphenyl)-5-(4-tert-butylphenyl)-1H-indole-2-carboxylic acid
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