But-2-enedioic acid--2-[(1-octyl-1H-indol-3-yl)sulfanyl]ethan-1-amine (1/1) (Q82803334)

chemical compound

Language	Label	Description	Also known as
English	But-2-enedioic acid--2-[(1-octyl-1H-indol-3-yl)sulfanyl]ethan-1-amine (1/1)	chemical compound

Statements

instance of

type of chemical entity

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subclass of

chemical compound

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mass

420.20827850399985 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₃₂N₂O₄S

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCCCCn1cc(SCCN)c2ccccc21.O=C(O)C=CC(=O)O

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C18H28N2S.C4H4O4/c1-2-3-4-5-6-9-13-20-15-18(21-14-12-19)16-10-7-8-11-17(16)20;5-3(6)1-2-4(7)8/h7-8,10-11,15H,2-6,9,12-14,19H2,1H3;1-2H,(H,5,6)(H,7,8)

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InChIKey

TYUUSRCFMAWURG-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

TYUUSRCFMAWURG-UHFFFAOYSA-N

1 reference

1 reference

matched by identifier from

InChIKey

TYUUSRCFMAWURG-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID10771996

0 references

But-2-enedioic acid--2-[(1-octyl-1H-indol-3-yl)sulfanyl]ethan-1-amine (1/1) (Q82803334)

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But-2-enedioic acid--2-[(1-octyl-1H-indol-3-yl)sulfanyl]ethan-1-amine (1/1) (Q82803334)

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Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

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