CAS Registry Number®
6581-06-2
CAS Name
3-Quinuclidinyl benzilate
Molecular Formula
C21H23NO3
Molecular Mass
337.41
Compound Properties
-
Melting Point (1)
164-165 °C
Source(s)
- (1) Pianfetti, John A.; US3118896, 1964, CAplus
Other Names and Identifiers
InChI
InChI=1S/C21H23NO3/c23-20(25-19-15-22-13-11-16(19)12-14-22)21(24,17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10,16,19,24H,11-15H2
InChIKey
InChIKey=HGMITUYOCPPQLE-UHFFFAOYSA-N
SMILES
C(C(OC1C2CCN(C1)CC2)=O)(O)(C3=CC=CC=C3)C4=CC=CC=C4
Canonical SMILES
O=C(OC1CN2CCC1CC2)C(O)(C=3C=CC=CC3)C=4C=CC=CC4
Other Names for this Substance
- Benzeneacetic acid, α-hydroxy-α-phenyl-, 1-azabicyclo[2.2.2]oct-3-yl ester
- Benzilic acid, 3-quinuclidinyl ester
- 3-Quinuclidinol, benzilate (ester)
- 3-Hydroxyquinuclidine benzilate
- Ro 2-3308
- 3-Quinuclidinyl benzilate
- 3-Quinuclidinol benzilate
- 3-Oxyquinuclidine benzilate
- 3-Quinuclidyl benzilate
- β-Quinuclidinyl benzilate
- QNB
- NSC 173698
- BZ
- Agent BZ
- BZ (chemical warfare agent)
- 2,2-Diphenyl-2-hydroxyacetic acid 3-quinuclidinyl ester
Deleted or Replaced CAS Registry Numbers
4478-53-9, 70135-17-0, 160902-51-2
