6-(4-Chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-4-acetic acid

CAS Registry Number®

1260530-42-4
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CAS Name

6-(4-Chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-4-acetic acid

Molecular Formula

C20H17ClN4O3

Molecular Mass

396.83

Cite this Page

6-(4-Chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-4-acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1260530-42-4 (retrieved 2024-09-10) (CAS RN: 1260530-42-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H17ClN4O3/c1-11-23-24-20-16(10-18(26)27)22-19(12-3-5-13(21)6-4-12)15-9-14(28-2)7-8-17(15)25(11)20/h3-9,16H,10H2,1-2H3,(H,26,27)

InChIKey

InChIKey=VEIZLTSJCDOIBH-UHFFFAOYSA-N

SMILES

O(C)C=1C=C2C(N3C(C(CC(O)=O)N=C2C4=CC=C(Cl)C=C4)=NN=C3C)=CC1

Canonical SMILES

O=C(O)CC1N=C(C=2C=CC(Cl)=CC2)C=3C=C(OC)C=CC3N4C(=NN=C41)C

Other Names for this Substance

  • 4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine-4-acetic acid, 6-(4-chlorophenyl)-8-methoxy-1-methyl-
  • 6-(4-Chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-4-acetic acid
  • 2-(6-(4-Chlorophenyl)-8-methoxy-1-methyl-4H-benzo[f][1,2,4]triazolo[4,3-a][1,4]diazepin-4-yl)acetic acid