Vitas-M small molecule compound

(4-methoxy-3-nitrophenyl)[3-(4-methoxyphenyl)-5,5-dimethyl-3,3a,4,5-tetrahydropyrano[3,4-c]pyrazol-2(7H)-yl]methanone

Catalog ID
STL297553
SMILES COc1ccc(cc1)C1C2CC(C)(C)OCC2=NN1C(=O)c1ccc(c(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 C23H25N3O6 MW 439.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O6/c1-23(2)12-17-18(13-32-23)24-25(21(17)14-5-8-16(30-3)9-6-14)22(27)15-7-10-20(31-4)19(11-15)26(28)29/h5-11,17,21H,12-13H2,1-4H3
InChIKey
UFFFDFKPRJCDEL-UHFFFAOYSA-N
Synonyms
300586-31-6
(4methoxy3nitrophenyl)(3(4methoxyphenyl)55dimethyl33a45tetrahydropyrano(34c)pyrazol2(7H)yl)methanone
(4METHOXY3NITROPHENYL)(3(4METHOXYPHENYL)55DIMETHYL33A47TETRAHYDROPYRANO(34C)PYRAZOL2YL)METHANONE
2((4METHOXY3NITROPHENYL)CARBONYL)3(4METHOXYPHENYL)55DIMETHYL233A457HEXAHYDROPYRANO(34C)PYRAZOLE
300586316
CC1(CC2C(N(N=C2CO1)C(=O)C3=CC(=C(C=C3)OC)(N+)(=O)(O))C4=CC=C(C=C4)OC)C
COc1ccc(cc1)C1C2CC(C)(C)OCC2=NN1C(=O)c1ccc(c(c1)(N+)(=O)(O))OC
InChI=1SC23H25N3O6c123(2)121718(133223)2425(21(17)145816(303)9614)22(27)1571020(314)19(1115)26(28)29h5111721H1213H214H3
MFCD01550618
ZINC000008926003
ZINC000013509944

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Available files

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