Vitas-M small molecule compound

Catalog ID
STK546133
SMILES O=C(C1[C@@H]2[C@H]1CCCC2)NNC(=O)c1ccc(=O)oc1

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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 C14H16N2O4 MW 276.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2O4/c17-11-6-5-8(7-20-11)13(18)15-16-14(19)12-9-3-1-2-4-10(9)12/h5-7,9-10,12H,1-4H2,(H,15,18)(H,16,19)/t9-,10+,12?
InChIKey
VYWLDBZAVCHREI-DHHPTOIESA-N
Synonyms
1212167-69-5
1212167695
6KETON((1S6R)NORCARANE7CARBONYL)PYRAN3CARBOHYDRAZIDE
6OXO6HPYRAN3CARBOXYLICACIDN((1S6R)BICYCLO(410)HEPTANE7CARBONYL)HYDRAZIDE
C1CCC2C(C1)C2C(=O)NNC(=O)C3=COC(=O)C=C3
InChI=1SC14H16N2O4c1711658(72011)13(18)151614(19)129312410(9)12h5791012H14H2(H1518)(H1619)t910+12?
MFCD03665675
N(((1S6R)7BICYCLO(410)HEPTANYL)CARBONYL)6OXIDANYLIDENEPYRAN3CARBOHYDRAZIDE
N(((1S6R)7BICYCLO(410)HEPTANYL)OXOMETHYL)6OXO3PYRANCARBOHYDRAZIDE
N((1R6S)BICYCLO(410)HEPTANE7CARBONYL)6OXOPYRAN3CARBOHYDRAZIDE
N((1R6S7r)bicyclo(410)heptane7carbonyl)2oxo2Hpyran5carbohydrazide
N((1S6R)BICYCLO(410)HEPTANE7CARBONYL)6OXOPYRAN3CARBOHYDRAZIDE
O=C(C1(C@@H)2(C@H)1CCCC2)NNC(=O)c1ccc(=O)oc1
ZINC000217762230
ZINC000245328651
ZINC18057668
ZINC217762230

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.