Squarain-carboxylate N-succinimidyl ester

Name: Squarain-carboxylate N-succinimidyl ester
SKU: ACM154161816
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CAS

154161-81-6

Catalog Number

ACM154161816

Category

Other Products

Molecular Weight

614.09

Molecular Formula

C₃₄H₃₂ClN₃O₆

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Specification

Synonyms

SQ-NHS, AC1NOW1Z, CTK8E7978, 154161-81-6, 4-[(5-chloro-1,3,3-trimethylindol-1-ium-2-yl)methylidene]-2-[[5-(2,5-dioxopyrrolidin-1-yl)oxycarbonyl-1-ethyl-3,3-dimethylindol-2-ylidene]methyl]-3-oxocyclobuten-1-olate

IUPAC Name

4-[(5-chloro-1,3,3-trimethylindol-1-ium-2-yl)methylidene]-2-[[5-(2,5-dioxopyrrolidin-1-yl)oxycarbonyl-1-ethyl-3,3-dimethylindol-2-ylidene]methyl]-3-oxocyclobuten-1-olate

Canonical SMILES

CCN1C2=C(C=C(C=C2)C(=O)ON3C(=O)CCC3=O)C(C1=CC4=C(C(=CC5=[N+](C6=C(C5(C)C)C=C(C=C6)Cl)C)C4=O)[O-])(C)C

InChI Key

RRLJXAKQFSXTLC-UHFFFAOYSA-N

Exact Mass

613.19800

H-Bond Acceptor

H-Bond Donor

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