SpectraBase Spectrum ID |
FxlOwX6A2l5 |
Name |
Benzoic acid, 4-[[[2-(acetylamino)-1,4-dihydro-4-oxo-6-pteridinyl]methylene]amino]- , methyl ester, (Z)- |
CAS Registry Number |
59040-13-0 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H14N6O4 |
InChI |
InChI=1S/C17H14N6O4/c1-9(24)20-17-22-14-13(15(25)23-17)21-12(8-19-14)7-18-11-5-3-10(4-6-11)16(26)27-2/h3-8H,1-2H3,(H2,19,20,22,23,24,25)/b18-7- |
InChIKey |
WTNKMDNGFOWULX-WSVATBPTSA-N |
Molecular Weight |
366.337 g/mol |
SMILES |
N1c2c(C(N=C1NC(=O)C)=O)nc(cn2)\C=N/c1ccc(C(=O)OC)cc1 |
SPLASH |
splash10-0cdi-0029000000-fdbce0ce16347f4ed673 |
Source of Spectrum |
H-59-246-3 |
Synonyms |
Methyl 4-({(Z)-[2-(acetylamino)-4-oxo-1,4-dihydro-6-pteridinyl]methylidene}amino)benzoate
N(2')-acetyl-6-(N-4'-methoxycarbonyl-phenyl)-iminomethyl)-pterine |
Wiley ID |
1351743 |