| SpectraBase Spectrum ID |
1cC3HTo5STu |
| Name |
Cyclohepta[4,5]pyrrolo[2,1-c][1,2,4]triazepine-4,12-dicarboxylic acid, 2,5-dihydro-5-oxo-, diethyl ester |
| CAS Registry Number |
115802-20-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H17N3O5 |
| InChI |
InChI=1S/C18H17N3O5/c1-3-25-17(23)12-10-19-20-15-14(18(24)26-4-2)11-8-6-5-7-9-13(11)21(15)16(12)22/h5-10,19H,3-4H2,1-2H3 |
| InChIKey |
PJTINFSXNYQFBU-UHFFFAOYSA-N |
| Molecular Weight |
355.350 g/mol |
| SMILES |
N1C=C(C(N2C(=N1)C(=C1C2=CC=CC=C1)C(=O)OCC)=O)C(=O)OCC |
| SPLASH |
splash10-0bti-0289000000-555bfcb171d3046623c9 |
| Source of Spectrum |
AJ-61-1441-6 |
| Synonyms |
Diethyl 5-oxo-2,5-dihydrocyclohepta[4,5]pyrrolo[2,1-c][1,2,4]triazepine-4,12-dicarboxylate
Ethyl 2,5-dihydro-5-oxo-1,2,5a-triazacyclohept[a]azulene-4,11-dicarboxylate |
| Wiley ID |
1345184 |
![Cyclohepta[4,5]pyrrolo[2,1-c][1,2,4]triazepine-4,12-dicarboxylic acid, 2,5-dihydro-5-oxo-, diethyl ester](/api/spectrum/1cC3HTo5STu/structure.png?h=300&w=458 "Cyclohepta[4,5]pyrrolo[2,1-c][1,2,4]triazepine-4,12-dicarboxylic acid, 2,5-dihydro-5-oxo-, diethyl ester")
