1H-Azepine-1-acetic acid, hexahydro-α-phenyl-, methyl ester, hydrochloride (1:1)
CAS Registry Number®
5460-80-0
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CAS Name
1H-Azepine-1-acetic acid, hexahydro-α-phenyl-, methyl ester, hydrochloride (1:1)Molecular Formula
C15H21NO2.ClHCite this Page
1H-Azepine-1-acetic acid, hexahydro-α-phenyl-, methyl ester, hydrochloride (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=5460-80-0 (retrieved ) (CAS RN: 5460-80-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C15H21NO2.ClH/c1-18-15(17)14(13-9-5-4-6-10-13)16-11-7-2-3-8-12-16;/h4-6,9-10,14H,2-3,7-8,11-12H2,1H3;1H
InChIKey
InChIKey=AWJQSIWTDMWZCO-UHFFFAOYSA-N
SMILES
C(C(OC)=O)(N1CCCCCC1)C2=CC=CC=C2.Cl
Canonical SMILES
Cl.O=C(OC)C(C=1C=CC=CC1)N2CCCCCC2
Other Names for this Substance
- 1H-Azepine-1-acetic acid, hexahydro-α-phenyl-, methyl ester, hydrochloride (1:1)
- 1H-Azepine-1-acetic acid, hexahydro-α-phenyl-, methyl ester, hydrochloride
- NSC 21336