| SpectraBase Spectrum ID |
9x5qHqqB7cK |
| Name |
3,4-Dihydro-4'-nitro-3-oxo-1-phenyl-2(1H)-isoquinolinecarboxanilide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
387.121906035 u |
| Formula |
C22H17N3O4 |
| InChI |
InChI=1S/C22H17N3O4/c26-20-14-16-8-4-5-9-19(16)21(15-6-2-1-3-7-15)24(20)22(27)23-17-10-12-18(13-11-17)25(28)29/h1-13,21H,14H2,(H,23,27) |
| InChIKey |
FILMWOVQKVVVAP-UHFFFAOYSA-N |
| Molecular Weight |
387.395 g/mol |
| SMILES |
N(C(N1C(CC=2C=CC=CC2C1C=1C=CC=CC1)=O)=O)C1=CC=C(C=C1)N(=O)=O |
| Spectrum/Structure Validation Score (Raman) |
0.931095 |
