| SpectraBase Spectrum ID |
BvkknZDFJgR |
| Name |
21H,23H-Porphin-5-ol,15-chloro-2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-, benzoate (ester) |
| CAS Registry Number |
63972-59-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C39H41ClN4O2 |
| InChI |
InChI=1S/C39H41ClN4O2/c1-9-25-22(7)34-33(40)36-27(11-3)20(5)29(41-36)18-32-26(10-2)23(8)35(44-32)38(46-39(45)24-16-14-13-15-17-24)37-28(12-4)21(6)30(42-37)19-31(25)43-34/h13-19,43-44H,9-12H2,1-8H3/b29-18-,30-19-,31-19-,32-18-,34-33+,36-33+,38-35+,38-37+ |
| InChIKey |
JNFOLKBWWDUICG-QDDBKZJXSA-N |
| Molecular Weight |
633.236 g/mol |
| SMILES |
[nH]1c2c(c(c1c(c1nc(cc3[nH]c(c(c4nc(c2)c(c4CC)C)OC(=O)c2ccccc2)c(c3CC)C)c(c1CC)C)Cl)C)CC |
| SPLASH |
splash10-0a4i-0000090000-028a9dcc1193e4b0fc5a |
| Source of Spectrum |
F-33-633-0 |
| Synonyms |
.alpha.-benzoyloxy-.gamma.-chloro-aetiophorphyrin-I
12-chloro-5,10,15,20-tetraethyl-4,9,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl benzoate |
| Wiley ID |
1412212 |
