1H-Purine-2,6-dione, 7-[2-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]ethyl]-3,7-dihydro-1,3-dimethyl-, hydrochloride (1:1)

CAS Registry Number®

2572-61-4

CAS Name

1H-Purine-2,6-dione, 7-[2-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]ethyl]-3,7-dihydro-1,3-dimethyl-, hydrochloride (1:1)

Molecular Formula

C17H21N5O5.ClH

Cite this Page

1H-Purine-2,6-dione, 7-[2-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]ethyl]-3,7-dihydro-1,3-dimethyl-, hydrochloride (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2572-61-4 (retrieved 2024-11-22) (CAS RN: 2572-61-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H21N5O5.ClH/c1-20-15-14(16(26)21(2)17(20)27)22(9-19-15)6-5-18-8-13(25)10-3-4-11(23)12(24)7-10;/h3-4,7,9,13,18,23-25H,5-6,8H2,1-2H3;1H

InChIKey

InChIKey=CSKCJAUXLOQTMM-UHFFFAOYSA-N

SMILES

C(CNCC(O)C1=CC(O)=C(O)C=C1)N2C3=C(N=C2)N(C)C(=O)N(C)C3=O.Cl

Canonical SMILES

Cl.O=C1C2=C(N=CN2CCNCC(O)C3=CC=C(O)C(O)=C3)N(C(=O)N1C)C

Other Names for this Substance

  • 1H-Purine-2,6-dione, 7-[2-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]ethyl]-3,7-dihydro-1,3-dimethyl-, hydrochloride (1:1)
  • Theophylline, 7-[2-[(β,3,4-trihydroxyphenethyl)amino]ethyl]-, monohydrochloride
  • 1H-Purine-2,6-dione, 7-[2-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]ethyl]-3,7-dihydro-1,3-dimethyl-, monohydrochloride
  • Theophylline, 7-[2-[(β,3,4-trihydroxyphenethyl)amino]ethyl]-, hydrochloride
  • NSC 293888

CAS INSIGHTSTM
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