3H-Indolium, 5-methoxy-2,3,3-trimethyl-1-(4-sulfobutyl)-, inner salt
CAS Registry Number®
54136-27-5
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CAS Name
3H-Indolium, 5-methoxy-2,3,3-trimethyl-1-(4-sulfobutyl)-, inner saltMolecular Formula
C16H23NO4SCite this Page
3H-Indolium, 5-methoxy-2,3,3-trimethyl-1-(4-sulfobutyl)-, inner salt. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=54136-27-5 (retrieved ) (CAS RN: 54136-27-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C16H23NO4S/c1-12-16(2,3)14-11-13(21-4)7-8-15(14)17(12)9-5-6-10-22(18,19)20/h7-8,11H,5-6,9-10H2,1-4H3
InChIKey
InChIKey=PVYCRNUCAJPUFN-UHFFFAOYSA-N
SMILES
C(CCCS(=O)(=O)[O-])[N+]=1C=2C(C(C)(C)C1C)=CC(OC)=CC2
Canonical SMILES
O=S(=O)([O-])CCCC[N+]=1C=2C=CC(OC)=CC2C(C1C)(C)C
Other Names for this Substance
- 3H-Indolium, 5-methoxy-2,3,3-trimethyl-1-(4-sulfobutyl)-, inner salt
