| SpectraBase Spectrum ID |
7knevTj5xaP |
| Name |
Methyl 4-{[(1E)-3-(butylamino)-8-hydroxy-4-oxonaphthalenylidene]amino}benzoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
378.157957192 u |
| Formula |
C22H22N2O4 |
| InChI |
InChI=1S/C22H22N2O4/c1-3-4-12-23-18-13-17(20-16(21(18)26)6-5-7-19(20)25)24-15-10-8-14(9-11-15)22(27)28-2/h5-11,13,23,25H,3-4,12H2,1-2H3/b24-17+ |
| InChIKey |
POOTXYWQUJJBEK-JJIBRWJFSA-N |
| Molecular Weight |
378.428 g/mol |
| SMILES |
OC=1C=CC=C2C1\C(C=C(C2=O)NCCCC)=N/C=1C=CC(C(=O)OC)=CC1 |
![methyl 4-{[(1E)-3-(butylamino)-8-hydroxy-4-oxonaphthalenylidene]amino}benzoate](/api/spectrum/7knevTj5xaP/structure.png?h=300&w=458 "methyl 4-{[(1E)-3-(butylamino)-8-hydroxy-4-oxonaphthalenylidene]amino}benzoate")
