3-Isoxazolecarboxylic acid, 4-[(4-amino-2-chlorophenoxy)methyl]-5-methyl-, methyl ester, hydrochloride (1:1)
CAS Registry Number®
1431964-97-4
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CAS Name
3-Isoxazolecarboxylic acid, 4-[(4-amino-2-chlorophenoxy)methyl]-5-methyl-, methyl ester, hydrochloride (1:1)Molecular Formula
C13H13ClN2O4.ClHCite this Page
3-Isoxazolecarboxylic acid, 4-[(4-amino-2-chlorophenoxy)methyl]-5-methyl-, 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=1431964-97-4 (retrieved ) (CAS RN: 1431964-97-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C13H13ClN2O4.ClH/c1-7-9(12(16-20-7)13(17)18-2)6-19-11-4-3-8(15)5-10(11)14;/h3-5H,6,15H2,1-2H3;1H
InChIKey
InChIKey=UURYLWLFATWXID-UHFFFAOYSA-N
SMILES
C(OC1=C(Cl)C=C(N)C=C1)C=2C(C(OC)=O)=NOC2C.Cl
Canonical SMILES
Cl.O=C(OC)C1=NOC(=C1COC2=CC=C(N)C=C2Cl)C
Other Names for this Substance
- 3-Isoxazolecarboxylic acid, 4-[(4-amino-2-chlorophenoxy)methyl]-5-methyl-, methyl ester, hydrochloride (1:1)