| SpectraBase Spectrum ID |
7XAXsuiyYTL |
| Name |
4a'-(Benzylcarbamoyl)-1',2',3',4',4a',5',10',11a'-octahydrospiro[cyclohexane-1,11'-dibenzo[b,e][1,4]diazepine]-7'-carboxylic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H33N3O3 |
| InChI |
InChI=1S/C27H33N3O3/c31-24(32)20-12-13-21-22(17-20)30-27(25(33)28-18-19-9-3-1-4-10-19)16-8-5-11-23(27)26(29-21)14-6-2-7-15-26/h1,3-4,9-10,12-13,17,23,29-30H,2,5-8,11,14-16,18H2,(H,28,33)(H,31,32) |
| InChIKey |
NEMXUNSTEYEQLG-UHFFFAOYSA-N |
| Molecular Weight |
447.579 g/mol |
| SMILES |
N1C2(C3C(C(NCc4ccccc4)=O)(Nc4cc(C(=O)O)ccc14)CCCC3)CCCCC2 |
| SPLASH |
splash10-090u-9214000000-08090d1f19f9af9cdbd0 |
| Source of Spectrum |
F-68-7832-4j |
| Wiley ID |
1717572 |
![4a'-(Benzylcarbamoyl)-1',2',3',4',4a',5',10',11a'-octahydrospiro[cyclohexane-1,11'-dibenzo[b,e][1,4]diazepine]-7'-carboxylic acid](/api/spectrum/7XAXsuiyYTL/structure.png?h=300&w=458 "4a'-(Benzylcarbamoyl)-1',2',3',4',4a',5',10',11a'-octahydrospiro[cyclohexane-1,11'-dibenzo[b,e][1,4]diazepine]-7'-carboxylic acid")
