Methyl 6-bromo-3-(2,3-dichlorophenyl)-2-(2-methoxy-2-oxoethyl)-4-oxo-3,4-dihydro-2H-1,3-benzoxazine-2-carboxylate
6380
Reference
Methyl 6-bromo-3-(2,3-dichlorophenyl)-2-(2-methoxy-2-oxoethyl)-4-oxo-3,4-dihydro-2H-1,3-benzoxazine-2-carboxylate Structure
Systematic / IUPAC Name: Methyl 6-bromo-3-(2,3-dichlorophenyl)-2-(2-methoxy-2-oxoethyl)-4-oxo-1,3-benzoxazine-2-carboxylate
ID: Reference6380
Other Names: 2H-1,3-Benzoxazine-2-acetic acid, 6-bromo-3-(2,3-dichlorophenyl)-3,4-dihydro-2-(methoxycarbonyl)-4-oxo-, methyl ester
Formula: C19H14BrCl2NO6
Spectral Data
Methyl 6-bromo-3-(2,3-dichlorophenyl)-2-(2-methoxy-2-oxoethyl)-4-oxo-3,4-dihydro-2H-1,3-benzoxazine-2-carboxylate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 1 |
| No. of Spectra | 117 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 2/28/2017 6:24:41 AM |
Identificators
| InChI | InChI=1S/C19H14BrCl2NO6/c1-27-15(24)9-19(18(26)28-2)23(13-5-3-4-12(21)16(13)22)17(25)11-8-10(20)6-7-14(11)29-19/h3-8H,9H2,1-2H3 |
| InChI Key | ZJIRRODTONIEGE-UHFFFAOYSA-N |
| Canonical SMILES | COC(=O)CC1(N(C(=O)C2=C(O1)C=CC(=C2)Br)C3=C(C(=CC=C3)Cl)Cl)C(=O)OC |
| CAS | |
| Splash | |
| Other Names | 2H-1,3-Benzoxazine-2-acetic acid, 6-bromo-3-(2,3-dichlorophenyl)-3,4-dihydro-2-(methoxycarbonyl)-4-oxo-, methyl ester |
In Other Databases
| ChEMBL | CHEMBL1493241 |
| ChemSpider | 294829 |
| PubChem | 332767 |