(Q83040177)

English

1-((4-Methylphenyl)sulfonyl)azepane

chemical compound

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Statements

type of chemical entity

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chemical compound

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253.362 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₃H₁₉NO₂S

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canonical SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

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Identifiers

InChI=1S/C13H19NO2S/c1-12-6-8-13(9-7-12)17(15,16)14-10-4-2-3-5-11-14/h6-9H,2-5,10-11H2,1H3

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WYGOYZNQMXVUEJ-UHFFFAOYSA-N

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CAS Registry Number

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UniChem compound ID

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DSSTox substance ID

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DSSTOX compound identifier

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