Vitas-M small molecule compound
2-amino-7,7-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK064181
SMILES N#CC1=C(N)OC2=C(C1c1cc3OCOc3cc1[N+](=O)[O-])C(=O)CC(C2)(C)C
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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 C19H17N3O6 MW 383.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O6/c1-19(2)5-12(23)17-15(6-19)28-18(21)10(7-20)16(17)9-3-13-14(27-8-26-13)4-11(9)22(24)25/h3-4,16H,5-6,8,21H2,1-2H3InChIKey
OCNARWYXAMJHCJ-UHFFFAOYSA-NSynonyms
309289-79-02AMINO5KETO77DIMETHYL4(6NITRO13BENZODIOXOL5YL)68DIHYDRO4HCHROMENE3CARBONITRILE
2AMINO77DIMETHYL4(6NITRO(2HBENZO(D)13DIOXOLAN5YL))5OXO4H678TRIHYDROCHROMENE3CARBONITRILE
2amino77dimethyl4(6nitro13benzodioxol5yl)5oxo5678tetrahydro4Hchromene3carbonitrile
2AMINO77DIMETHYL4(6NITRO13BENZODIOXOL5YL)5OXO68DIHYDRO4H1BENZOPYRAN3CARBONITRILE
2AMINO77DIMETHYL4(6NITRO13BENZODIOXOL5YL)5OXO68DIHYDRO4HCHROMENE3CARBONITRILE
2AZANYL77DIMETHYL4(6NITRO13BENZODIOXOL5YL)5OXIDANYLIDENE68DIHYDRO4HCHROMENE3CARBONITRILE
309289790
CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC4=C(C=C3(N+)(=O)(O))OCO4)C(=O)C1)C
InChI=1SC19H17N3O6c119(2)512(23)1715(619)2818(21)10(720)16(17)931314(2782613)411(9)22(24)25h3416H56821H212H3
MFCD00551560
N#CC1=C(N)OC2=C(C1c1cc3OCOc3cc1(N+)(=O)(O))C(=O)CC(C2)(C)C
STK064181
ZINC000000856156
ZINC000000856157
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