Vitas-M small molecule compound
prop-2-en-1-yl 6'-amino-5'-cyano-2'-methyl-5-nitro-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Catalog ID
STK790863
SMILES C=CCOC(=O)C1=C(C)OC(=C(C21C(=O)Nc1c2cc(cc1)[N+](=O)[O-])C#N)N
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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 C18H14N4O6 MW 382.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N4O6/c1-3-6-27-16(23)14-9(2)28-15(20)12(8-19)18(14)11-7-10(22(25)26)4-5-13(11)21-17(18)24/h3-5,7H,1,6,20H2,2H3,(H,21,24)InChIKey
YDOSQZVCTNXPJZ-UHFFFAOYSA-NSynonyms
311333-51-4311333514
allyl2amino3cyano6methyl5nitro2oxospiro(indoline34pyran)5carboxylate
C=CCOC(=O)C1=C(C)OC(=C(C21C(=O)Nc1c2cc(cc1)(N+)(=O)(O))C#N)N
CC1=C(C2(C3=C(C=CC(=C3)(N+)(=O)(O))NC2=O)C(=C(O1)N)C#N)C(=O)OCC=C
InChI=1SC18H14N4O6c1362716(23)149(2)2815(20)12(819)18(14)11710(22(25)26)4513(11)2117(18)24h357H1620H22H3(H2124)
MFCD00825130
prop2en1yl6amino5cyano2methyl5nitro2oxo12dihydrospiro(indole34pyran)3carboxylate
PROP2ENYL6AMINO5CYANO2METHYL5NITRO2OXOSPIRO(1HINDOLE34PYRAN)3CARBOXYLATE
ZINC000004189115
ZINC000004189117
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