SpectraBase Spectrum ID |
ASSG7IXk9PA |
Name |
5-(4-Chlorophenyl)-1,3-dimethylpyrazolo[3',4':6,7]azepino[5,4,3-cd]indole |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
346.098524199 u |
Formula |
C20H15ClN4 |
InChI |
InChI=1S/C20H15ClN4/c1-11-18-20(25(2)24-11)15-10-22-16-5-3-4-14(17(15)16)19(23-18)12-6-8-13(21)9-7-12/h3-10,22H,1-2H3 |
InChIKey |
MXDCPBSMSIXPDO-UHFFFAOYSA-N |
Molecular Weight |
346.821 g/mol |
SMILES |
C12=C(C=3C=4C(=CC=CC4C(=N2)C2=CC=C(C=C2)Cl)NC3)N(C)N=C1C |