Vitas-M small molecule compound

2-(3,4-dimethoxyphenyl)-7-methoxy-5-(3-nitrophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine

Catalog ID
STK840562
SMILES COc1cc(ccc1OC)C1=NN2C(C1)c1cccc(c1OC2c1cccc(c1)[N+](=O)[O-])OC

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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 C25H23N3O6 MW 461.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O6/c1-31-21-11-10-15(13-23(21)33-3)19-14-20-18-8-5-9-22(32-2)24(18)34-25(27(20)26-19)16-6-4-7-17(12-16)28(29)30/h4-13,20,25H,14H2,1-3H3
InChIKey
MAELGRJYCNVOHT-UHFFFAOYSA-N
Synonyms
371139-03-6
12DIMETHOXY4(4METHOXY6(3NITROPHENYL)(6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN9YL))BENZENE
2(34dimethoxyphenyl)7methoxy5(3nitrophenyl)110bdihydropyrazolo(15c)(13)benzoxazine
2(34dimethoxyphenyl)7methoxy5(3nitrophenyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
2(34DIMETHOXYPHENYL)7METHOXY5(3NITROPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
371139036
COC1=C(C=C(C=C1)C2=NN3C(C2)C4=C(C(=CC=C4)OC)OC3C5=CC(=CC=C5)(N+)(=O)(O))OC
COc1cc(ccc1OC)C1=NN2C(C1)c1cccc(c1OC2c1cccc(c1)(N+)(=O)(O))OC
InChI=1SC25H23N3O6c13121111015(1323(21)333)1914201885922(322)24(18)3425(27(20)2619)1664717(1216)28(29)30h4132025H14H213H3
MFCD03008836
ZINC000008836192
ZINC000245238369

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Available files

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