1,1-Dimethylethyl 2-(4-aminobenzoyl)hexahydro-1H-1,2-diazepine-1-carboxylate

CAS Registry Number®

1135283-03-2
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CAS Name

1,1-Dimethylethyl 2-(4-aminobenzoyl)hexahydro-1H-1,2-diazepine-1-carboxylate

Molecular Formula

C17H25N3O3

Molecular Mass

319.40

Cite this Page

1,1-Dimethylethyl 2-(4-aminobenzoyl)hexahydro-1H-1,2-diazepine-1-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1135283-03-2 (retrieved 2024-06-26) (CAS RN: 1135283-03-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H25N3O3/c1-17(2,3)23-16(22)20-12-6-4-5-11-19(20)15(21)13-7-9-14(18)10-8-13/h7-10H,4-6,11-12,18H2,1-3H3

InChIKey

InChIKey=PRZLFYZGKUTAKL-UHFFFAOYSA-N

SMILES

C(OC(C)(C)C)(=O)N1N(C(=O)C2=CC=C(N)C=C2)CCCCC1

Canonical SMILES

O=C(OC(C)(C)C)N1N(C(=O)C2=CC=C(N)C=C2)CCCCC1

Other Names for this Substance

  • 1H-1,2-Diazepine-1-carboxylic acid, 2-(4-aminobenzoyl)hexahydro-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 2-(4-aminobenzoyl)hexahydro-1H-1,2-diazepine-1-carboxylate

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