Propanedioic acid, compd. with α-[2-[[2-hydroxy-2-(4-hydroxyphenyl)-1-methylethyl]amino]ethyl]-α-phenyl-2-thiophenemethanol (1:1)
CAS Registry Number®
23973-93-5
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CAS Name
Propanedioic acid, compd. with α-[2-[[2-hydroxy-2-(4-hydroxyphenyl)-1-methylethyl]amino]ethyl]-α-phenyl-2-thiophenemethanol (1:1)Molecular Formula
C22H25NO3S.C3H4O4Cite this Page
Propanedioic acid, compd. with α-[2-[[2-hydroxy-2-(4-hydroxyphenyl)-1-methylethyl]amino]ethyl]-α-phenyl-2-thiophenemethanol (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=23973-93-5 (retrieved ) (CAS RN: 23973-93-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C22H25NO3S.C3H4O4/c1-16(21(25)17-9-11-19(24)12-10-17)23-14-13-22(26,20-8-5-15-27-20)18-6-3-2-4-7-18;4-2(5)1-3(6)7/h2-12,15-16,21,23-26H,13-14H2,1H3;1H2,(H,4,5)(H,6,7)
InChIKey
InChIKey=PMUYNEPFLRSMTI-UHFFFAOYSA-N
SMILES
C(CCNC(C(O)C1=CC=C(O)C=C1)C)(O)(C2=CC=CS2)C3=CC=CC=C3.C(C(O)=O)C(O)=O
Canonical SMILES
O=C(O)CC(=O)O.OC1=CC=C(C=C1)C(O)C(NCCC(O)(C=2SC=CC2)C=3C=CC=CC3)C
Other Names for this Substance
- Propanedioic acid, compd. with α-[2-[[2-hydroxy-2-(4-hydroxyphenyl)-1-methylethyl]amino]ethyl]-α-phenyl-2-thiophenemethanol (1:1)
- Malonic acid, compd. with α-[2-[(p,β-dihydroxy-α-methylphenethyl)amino]ethyl]-α-phenyl-2-thiophenemethanol (1:1)
- 2-Thiophenemethanol, α-[2-[(p,β-dihydroxy-α-methylphenethyl)amino]ethyl]-α-phenyl-, malonate (1:1) (salt)
