| SpectraBase Spectrum ID |
4fLNVKx2Zex |
| Name |
2-Naphthalenecarboxylic acid, 6-chloro-7-(2,4-dimethoxy-4-oxo-2-butenyl)-5,8-dihydro-3-methoxy-1-methyl-5,8-dioxo-, ethyl ester |
| CAS Registry Number |
80756-21-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H21ClO8 |
| InChI |
InChI=1S/C21H21ClO8/c1-6-30-21(26)17-10(2)16-12(9-14(17)28-4)20(25)18(22)13(19(16)24)7-11(27-3)8-15(23)29-5/h8-9H,6-7H2,1-5H3/b11-8- |
| InChIKey |
LNHDJWDRPARMRF-FLIBITNWSA-N |
| Molecular Weight |
436.844 g/mol |
| SMILES |
C=1(C(c2c(c(C(=O)OCC)c(cc2C(C1Cl)=O)OC)C)=O)C\C(=C\C(=O)OC)OC |
| SPLASH |
splash10-05rc-0009500000-9745713edaf82be6ce75 |
| Source of Spectrum |
B-34-2420-0 |
| Synonyms |
Ethyl 6-chloro-7-[(2Z)-2,4-dimethoxy-4-oxo-2-butenyl]-3-methoxy-1-methyl-5,8-dioxo-5,8-dihydro-2-naphthalenecarboxylate
Methyl 4-(2'-chloro-6'-ethoxycarbonyl-7'-methoxy-5'-methyl-1',4'-naphthoquinon-3'-yl)-3-methoxybut-2-enoate |
| Wiley ID |
1383420 |
