(Q82006573)

English

3-(5-anilino-2-ethoxy-4-methylphenyl)-3-[4-(diethylamino)-2-hydroxyphenyl]-1-oxo-1,3-dihydro-2-benzofuran-5-carboxylic acid

chemical compound

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Statements

type of chemical entity

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chemical compound

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566.2416868079999 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₄H₃₄N₂O₆

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based on heuristic

inferred from SMILES

canonical SMILES

CCOc1cc(C)c(Nc2ccccc2)cc1C1(c2ccc(N(CC)CC)cc2O)OC(=O)c2ccc(C(=O)O)cc21

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C34H34N2O6/c1-5-36(6-2)24-14-16-26(30(37)19-24)34(27-18-22(32(38)39)13-15-25(27)33(40)42-34)28-20-29(21(4)17-31(28)41-7-3)35-23-11-9-8-10-12-23/h8-20,35,37H,5-7H2,1-4H3,(H,38,39)

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HHRJYJYCVVVXJZ-UHFFFAOYSA-N

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CAS Registry Number

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26 December 2021

UniChem compound ID

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DSSTox substance ID

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DSSTOX compound identifier

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