Vitas-M small molecule compound
2-[4-(4-nitrophenoxy)phenyl]-2-oxoethyl 4-(3,4-dicyanophenoxy)benzoate
Catalog ID
STK388990
SMILES N#Cc1ccc(cc1C#N)Oc1ccc(cc1)C(=O)OCC(=O)c1ccc(cc1)Oc1ccc(cc1)[N+](=O)[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 C29H17N3O7 MW 519.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H17N3O7/c30-16-21-5-12-27(15-22(21)17-31)39-25-10-3-20(4-11-25)29(34)37-18-28(33)19-1-8-24(9-2-19)38-26-13-6-23(7-14-26)32(35)36/h1-15H,18H2InChIKey
AFIPBLPVHALGGB-UHFFFAOYSA-NSynonyms
355435-47-1(2(4(4NITROPHENOXY)PHENYL)2OXOETHYL)4(34DICYANOPHENOXY)BENZOATE
2(4(4nitrophenoxy)phenyl)2oxoethyl4(34dicyanophenoxy)benzoate
355435471
C1=CC(=CC=C1C(=O)COC(=O)C2=CC=C(C=C2)OC3=CC(=C(C=C3)C#N)C#N)OC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC29H17N3O7c30162151227(1522(21)1731)392510320(41125)29(34)371828(33)191824(9219)382613623(71426)32(35)36h115H18H2
MFCD02376065
N#Cc1ccc(cc1C#N)Oc1ccc(cc1)C(=O)OCC(=O)c1ccc(cc1)Oc1ccc(cc1)(N+)(=O)(O)
ZINC000001837998
ZINC01837998
ZINC1837998
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