Benzeneacetic acid, α-hydroxy-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, endo-, sulfate (2:1) (salt)
CAS Registry Number®
20223-46-5
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CAS Name
Benzeneacetic acid, α-hydroxy-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, endo-, sulfate (2:1) (salt)Molecular Formula
C16H21NO3.1/2H2O4SCite this Page
Benzeneacetic acid, α-hydroxy-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, endo-, sulfate (2:1) (salt). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=20223-46-5 (retrieved ) (CAS RN: 20223-46-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1/C16H21NO3.H2O4S/c1-17-12-7-8-13(17)10-14(9-12)20-16(19)15(18)11-5-3-2-4-6-11;1-5(2,3)4/h2-6,12-15,18H,7-10H2,1H3;(H2,1,2,3,4)/t12-,13+,14+,15?;
InChIKey
InChIKey=ZZOSIOCTMHKYOZ-RDYJJYPNNA-N
SMILES
S(=O)(=O)(O)O.O(C(C(O)C1=CC=CC=C1)=O)[C@H]2C[C@@]3(N(C)[C@](C2)(CC3)[H])[H]
Canonical SMILES
O=C(OC1CC2N(C)C(CC2)C1)C(O)C=3C=CC=CC3.O=S(=O)(O)O
Other Names for this Substance
- Benzeneacetic acid, α-hydroxy-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, endo-, sulfate (2:1) (salt)
- 1αH,5αH-Tropan-3α-ol, (-)-mandelate (ester), sulfate (2:1) (salt)
- Homatropine sulfate
Deleted or Replaced CAS Registry Numbers
637-22-9, 16199-27-2
