| SpectraBase Spectrum ID |
6ypATgNaB2b |
| Name |
21H,23H-Porphine-2,18-dipropanoic acid, 8-(2-chloroethyl)-3,7,12,17-tetramethyl-, dimethyl ester |
| CAS Registry Number |
52459-78-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C34H37ClN4O4 |
| InChI |
InChI=1S/C34H37ClN4O4/c1-18-13-22-14-27-19(2)23(7-9-33(40)42-5)31(37-27)17-32-24(8-10-34(41)43-6)20(3)28(39-32)16-29-21(4)25(11-12-35)30(38-29)15-26(18)36-22/h13-17,36,39H,7-12H2,1-6H3/b22-14-,26-15-,27-14-,28-16-,29-16-,30-15-,31-17-,32-17- |
| InChIKey |
UUYDIOZYGZPIMI-OAOVUZDNSA-N |
| Molecular Weight |
601.147 g/mol |
| SMILES |
[nH]1c2cc(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4CCC(=O)OC)C)c(c3C)CCC(=O)OC)c(c1CCCl)C)C |
| SPLASH |
splash10-0udi-9000038000-a08e7491ec6238d5c2b5 |
| Source of Spectrum |
KC-1976-2504-0 |
| Synonyms |
2-(2-Chloroethyl)-6,7-bis-(2-methoxy carbonylethyl)-1,3,5,8-tetramethyl-porphin
Methyl 3-[10-(2-chloroethyl)-20-(3-methoxy-3-oxopropyl)-5,9,14,19-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-4-yl]propanoate |
| Wiley ID |
1410141 |
