1H-Azepine-4-carboxylic acid, hexahydro-1-methyl-4-phenyl-, ethyl ester, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
CAS Registry Number®
6700-56-7
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CAS Name
1H-Azepine-4-carboxylic acid, hexahydro-1-methyl-4-phenyl-, ethyl ester, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)Molecular Formula
C16H23NO2.C6H8O7Cite this Page
1H-Azepine-4-carboxylic acid, hexahydro-1-methyl-4-phenyl-, ethyl ester, 2-hydroxy-1,2,3-propanetricarboxylate (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=6700-56-7 (retrieved ) (CAS RN: 6700-56-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C16H23NO2.C6H8O7/c1-3-19-15(18)16(14-8-5-4-6-9-14)10-7-12-17(2)13-11-16;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-6,8-9H,3,7,10-13H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChIKey
InChIKey=KCVHFFSPDODYOG-UHFFFAOYSA-N
SMILES
C(CC(O)=O)(CC(O)=O)(C(O)=O)O.C(OCC)(=O)C1(CCN(C)CCC1)C2=CC=CC=C2
Canonical SMILES
O=C(O)CC(O)(C(=O)O)CC(=O)O.O=C(OCC)C1(C=2C=CC=CC2)CCN(C)CCC1
Other Names for this Substance
- 1H-Azepine-4-carboxylic acid, hexahydro-1-methyl-4-phenyl-, ethyl ester, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
- Azepine-4-carboxylic acid, hexahydro-1-methyl-4-phenyl-, ethyl ester, citrate (1:1)
- Azepine-4-carboxylic acid, hexahydro-1-methyl-4-phenyl-, ethyl ester, citrate
- Ethoheptazine citrate
- Zactane
Deleted or Replaced CAS Registry Numbers
1446-48-6, 2085-42-9, 6078-45-1, 38423-94-8
