1,1-Dimethylethyl 1,2,3,5-tetrahydro-7-hydroxy-4H-1,4-benzodiazepine-4-carboxylate

CAS Registry Number®

886364-39-2
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CAS Name

1,1-Dimethylethyl 1,2,3,5-tetrahydro-7-hydroxy-4H-1,4-benzodiazepine-4-carboxylate

Molecular Formula

C14H20N2O3

Molecular Mass

264.32

Cite this Page

1,1-Dimethylethyl 1,2,3,5-tetrahydro-7-hydroxy-4H-1,4-benzodiazepine-4-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=886364-39-2 (retrieved 2024-09-07) (CAS RN: 886364-39-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H20N2O3/c1-14(2,3)19-13(18)16-7-6-15-12-5-4-11(17)8-10(12)9-16/h4-5,8,15,17H,6-7,9H2,1-3H3

InChIKey

InChIKey=FYILRTSVQZCYTE-UHFFFAOYSA-N

SMILES

C(OC(C)(C)C)(=O)N1CC=2C(NCC1)=CC=C(O)C2

Canonical SMILES

O=C(OC(C)(C)C)N1CC2=CC(O)=CC=C2NCC1

Other Names for this Substance

  • 4H-1,4-Benzodiazepine-4-carboxylic acid, 1,2,3,5-tetrahydro-7-hydroxy-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 1,2,3,5-tetrahydro-7-hydroxy-4H-1,4-benzodiazepine-4-carboxylate