| Formula |
C27H41ClN4O5 |
| IUPAC Name |
ammonia; [(3r)-quinuclidin-3-yl] 6-[(1s,3s,4r)-4-[(3-hydroxy-2-methyl-propanoyl)amino]-3-methoxy-1-piperidyl]hexanoate; chloride |
| Molecular Mass |
537.091 g·mol−1 |
| Heat of Formation |
-911.3 ± 16.7 kJ·mol−1 |
| Dipole Moment |
8.40 ± 1.08 D |
| Volume |
649.88 Å 3 |
| Surface Area |
558.04 Å 2 |
| HOMO Energy |
-8.67 ± 0.55 eV |
| LUMO Energy |
2.85 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 6-[(3s,4r)-4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methoxy-1-piperidyl]hexanoic acid [(3r)-quinuclidin-3-yl] ester
- 6-[(3s,4r)-4-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-3-methoxy-1-piperidinyl]hexanoic acid [(3r)-3-quinuclidinyl] ester
- [(3r)-quinuclidin-3-yl] 6-[(3s,4r)-4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methoxy-1-piperidyl]hexanoate
- [(8r)-1-azabicyclo[2.2.2]octan-8-yl] 6-[(3s,4r)-4-[(4-amino-5-chloro-2-methoxy-phenyl)carbonylamino]-3-methoxy-piperidin-1-yl]hexanoate
- [(8r)-1-azabicyclo[2.2.2]octan-8-yl] 6-[(3s,4r)-4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]-3-methoxypiperidin-1-yl]hexanoate
|
| InChIKey |
VGDDOIZXGFJDRC-VJTSUQJLSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
C
N
O
Cl
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