| SpectraBase Spectrum ID |
KH5KjhRNtDY |
| Name |
4-(2-Amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)phenyl 2-chlorobenzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H17ClN2O4 |
| InChI |
InChI=1S/C23H17ClN2O4/c24-17-5-2-1-4-15(17)23(28)29-14-10-8-13(9-11-14)20-16(12-25)22(26)30-19-7-3-6-18(27)21(19)20/h1-2,4-5,8-11,20H,3,6-7,26H2 |
| InChIKey |
XFNFPMJHZHFMTL-UHFFFAOYSA-N |
| Molecular Weight |
420.852 g/mol |
| SMILES |
NC1=C(C(C2=C(CCCC2=O)O1)c1ccc(OC(c2c(Cl)cccc2)=O)cc1)C#N |
| SPLASH |
splash10-000l-9800000000-cf46b07a4b84c4cceb44 |
| Synonyms |
2-Chlorobenzoic acid [4-(2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-4-yl)phenyl] ester
[4-(2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydrochromen-4-yl)phenyl] 2-chlorobenzoate
[4-(2-azanyl-3-cyano-5-oxidanylidene-4,6,7,8-tetrahydrochromen-4-yl)phenyl] 2-chloranylbenzoate |
| Wiley ID |
1445396 |
