6-Chloro-2-[[(diphenylmethoxy)carbonyl]amino]-9H-purine-9-acetic acid

CAS Registry Number®

1951439-75-0
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CAS Name

6-Chloro-2-[[(diphenylmethoxy)carbonyl]amino]-9H-purine-9-acetic acid

Molecular Formula

C21H16ClN5O4

Molecular Mass

437.84

Cite this Page

6-Chloro-2-[[(diphenylmethoxy)carbonyl]amino]-9H-purine-9-acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1951439-75-0 (retrieved 2024-07-02) (CAS RN: 1951439-75-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H16ClN5O4/c22-18-16-19(27(12-23-16)11-15(28)29)25-20(24-18)26-21(30)31-17(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,12,17H,11H2,(H,28,29)(H,24,25,26,30)

InChIKey

InChIKey=UASOFVPBAAJJID-UHFFFAOYSA-N

SMILES

C(C(O)=O)N1C=2C(N=C1)=C(Cl)N=C(NC(OC(C3=CC=CC=C3)C4=CC=CC=C4)=O)N2

Canonical SMILES

O=C(O)CN1C=NC=2C(Cl)=NC(=NC21)NC(=O)OC(C=3C=CC=CC3)C=4C=CC=CC4

Other Names for this Substance

  • 9H-Purine-9-acetic acid, 6-chloro-2-[[(diphenylmethoxy)carbonyl]amino]-
  • 6-Chloro-2-[[(diphenylmethoxy)carbonyl]amino]-9H-purine-9-acetic acid