3-Thiopheneacetic acid, α-cyclohexyl-, 2-(hexahydro-1H-azepin-1-yl)ethyl ester, hydrochloride (1:1)
CAS Registry Number®
16199-90-9
CAS Name
3-Thiopheneacetic acid, α-cyclohexyl-, 2-(hexahydro-1H-azepin-1-yl)ethyl ester, hydrochloride (1:1)Molecular Formula
C20H31NO2S.ClHCite this Page
3-Thiopheneacetic acid, α-cyclohexyl-, 2-(hexahydro-1H-azepin-1-yl)ethyl ester, hydrochloride (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=16199-90-9 (retrieved ) (CAS RN: 16199-90-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C20H31NO2S.ClH/c22-20(23-14-13-21-11-6-1-2-7-12-21)19(18-10-15-24-16-18)17-8-4-3-5-9-17;/h10,15-17,19H,1-9,11-14H2;1H
InChIKey
InChIKey=ASHVUIMZSYNBHE-UHFFFAOYSA-N
SMILES
C(C(OCCN1CCCCCC1)=O)(C=2C=CSC2)C3CCCCC3.Cl
Canonical SMILES
Cl.O=C(OCCN1CCCCCC1)C(C2=CSC=C2)C3CCCCC3
Other Names for this Substance
- 3-Thiopheneacetic acid, α-cyclohexyl-, 2-(hexahydro-1H-azepin-1-yl)ethyl ester, hydrochloride (1:1)
- 3-Thiopheneacetic acid, α-cyclohexyl-, 2-(hexahydro-1H-azepin-1-yl)ethyl ester, hydrochloride
- 1H-Azepine-1-ethanol, hexahydro-, α-cyclohexyl-3-thiopheneacetate (ester), hydrochloride
- 1781E