Vitas-M small molecule compound
9-bromo-5-(2-nitrophenyl)-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STL194182
SMILES Brc1ccc2c(c1)C1CC(=NN1C(O2)c1ccccc1[N+](=O)[O-])c1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H16BrN3O3 MW 450.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16BrN3O3/c23-15-10-11-21-17(12-15)20-13-18(14-6-2-1-3-7-14)24-25(20)22(29-21)16-8-4-5-9-19(16)26(27)28/h1-12,20,22H,13H2InChIKey
GOACCKYVWDKBFM-UHFFFAOYSA-NSynonyms
9bromo5(2nitrophenyl)2phenyl110bdihydropyrazolo(15c)(13)benzoxazine
9bromo5(2nitrophenyl)2phenyl510bdihydro1Hpyrazolo(15c)(13)benzoxazine
Brc1ccc2c(c1)C1CC(=NN1C(O2)c1ccccc1(N+)(=O)(O))c1ccccc1
C1C2C3=C(C=CC(=C3)Br)OC(N2N=C1C4=CC=CC=C4)C5=CC=CC=C5(N+)(=O)(O)
InChI=1SC22H16BrN3O3c231510112117(1215)201318(146213714)2425(20)22(2921)16845919(16)26(27)28h1122022H13H2
MFCD01627509
ZINC000019880873
ZINC000101075030
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