Vitas-M small molecule compound
7,11-dicyano-10-hydroxy-3-methyl-9-aza-3-azoniaspiro[5.5]undeca-7,10-dien-8-olate
Catalog ID
STK777162
SMILES N#CC1=C([O-])NC(=C(C21CC[NH+](CC2)C)C#N)O
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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 C12H14N4O2 MW 246.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N4O2/c1-16-4-2-12(3-5-16)8(6-13)10(17)15-11(18)9(12)7-14/h15,17-18H,2-5H2,1H3InChIKey
OJWBVPRUGKJHLI-UHFFFAOYSA-NSynonyms
15dicyano2hydroxy9methyl3aza9azoniaspiro(55)undeca14dien4olate
711dicyano10hydroxy3methyl9aza3azoniaspiro(55)undeca710dien8olate
711DICYANO8HYDROXY3METHYL9AZA3AZONIASPIRO(55)UNDECA710DIEN10OLATE
810DIHYDROXY3METHYL39DIAZASPIRO(55)UNDECA710DIENE711DICARBONITRILE
C(NH+)1CCC2(CC1)C(=C(NC(=C2C#N)(O))O)C#N
InChI=1SC12H14N4O2c1164212(3516)8(613)10(17)1511(18)9(12)714h151718H25H21H3
MFCD08141953
N#CC1=C((O))NC(=C(C21CC(NH+)(CC2)C)C#N)O
ZINC000004502081
ZINC4502081
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