SpectraBase Spectrum ID |
5neXbiJ9ABC |
Name |
Nicardipine-m (deamino-hooc-) me P1459 |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
404.121965604 u |
Formula |
C19H20N2O8 |
InChI |
InChI=1S/C19H20N2O8/c1-10-15(18(23)28-4)17(12-6-5-7-13(8-12)21(25)26)16(11(2)20-10)19(24)29-9-14(22)27-3/h5-8,17,20H,9H2,1-4H3 |
InChIKey |
XIXUCBSISABPEU-UHFFFAOYSA-N |
Molecular Weight |
404.375 g/mol |
SMILES |
C=1(C(C(C(=O)OC)=C(NC1C)C)C=1C=C(N(=O)=O)C=CC1)C(OCC(=O)OC)=O |