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

CAS Registry Number®

886364-42-7
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CAS Name

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

Molecular Formula

C15H22N2O2

Molecular Mass

262.35

Cite this Page

1,1-Dimethylethyl 1,2,3,5-tetrahydro-7-methyl-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=886364-42-7 (retrieved 2024-09-07) (CAS RN: 886364-42-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H22N2O2/c1-11-5-6-13-12(9-11)10-17(8-7-16-13)14(18)19-15(2,3)4/h5-6,9,16H,7-8,10H2,1-4H3

InChIKey

InChIKey=KWCCHKFPRQBBFJ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

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