1H-1,4-Diazepine, hexahydro-1-[4-nitro-3-(trifluoromethyl)phenyl]-, hydrochloride (1:1)
CAS Registry Number®
1185298-60-5
CAS Name
1H-1,4-Diazepine, hexahydro-1-[4-nitro-3-(trifluoromethyl)phenyl]-, hydrochloride (1:1)Molecular Formula
C12H14F3N3O2.ClHCite this Page
1H-1,4-Diazepine, hexahydro-1-[4-nitro-3-(trifluoromethyl)phenyl]-, hydrochloride (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1185298-60-5 (retrieved ) (CAS RN: 1185298-60-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C12H14F3N3O2.ClH/c13-12(14,15)10-8-9(2-3-11(10)18(19)20)17-6-1-4-16-5-7-17;/h2-3,8,16H,1,4-7H2;1H
InChIKey
InChIKey=STNRRNLNJXCZQM-UHFFFAOYSA-N
SMILES
C(F)(F)(F)C1=C(N(=O)=O)C=CC(=C1)N2CCCNCC2.Cl
Canonical SMILES
Cl.O=N(=O)C1=CC=C(C=C1C(F)(F)F)N2CCNCCC2
Other Names for this Substance
- 1H-1,4-Diazepine, hexahydro-1-[4-nitro-3-(trifluoromethyl)phenyl]-, hydrochloride (1:1)