SpectraBase Spectrum ID |
F7aT2RFKlce |
Name |
Nicardipine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
479.205635660 u |
Formula |
C26H29N3O6 |
InChI |
InChI=1S/C26H29N3O6/c1-17-22(25(30)34-4)24(20-11-8-12-21(15-20)29(32)33)23(18(2)27-17)26(31)35-14-13-28(3)16-19-9-6-5-7-10-19/h5-12,15,24,27H,13-14,16H2,1-4H3 |
InChIKey |
ZBBHBTPTTSWHBA-UHFFFAOYSA-N |
Molecular Weight |
479.533 g/mol |
SMILES |
N1C(=C(C(C=2C=C(C=CC2)N(=O)=O)C(=C1C)C(OC)=O)C(OCCN(CC=1C=CC=CC1)C)=O)C |
Spectrum/Structure Validation Score (Raman) |
0.930489 |