Vitas-M small molecule compound

2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-4-nitro-1H-isoindole-1,3(2H)-dione

Catalog ID
STK062568
SMILES O=C(N1CCc2c(C1)cccc2)CN1C(=O)c2c(C1=O)cccc2[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 C19H15N3O5 MW 365.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O5/c23-16(20-9-8-12-4-1-2-5-13(12)10-20)11-21-18(24)14-6-3-7-15(22(26)27)17(14)19(21)25/h1-7H,8-11H2
InChIKey
QOMJNWILGQQFNM-UHFFFAOYSA-N
Synonyms
364609-31-4
2(2(34DIHYDRO1HISOQUINOLIN2YL)2OXOETHYL)4NITROISOINDOLE13DIONE
2(2(34DIHYDROISOQUINOLIN2(1H)YL)2OXOETHYL)4NITRO1HISOINDOLE13(2H)DIONE
2(2(34dihydroisoquinolin2(1H)yl)2oxoethyl)4nitroisoindoline13dione
364609314
C1CN(CC2=CC=CC=C21)C(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)(N+)(=O)(O)
InChI=1SC19H15N3O5c2316(209812412513(12)1020)112118(24)1463715(22(26)27)17(14)19(21)25h17H811H2
MFCD01951869
O=C(N1CCc2c(C1)cccc2)CN1C(=O)c2c(C1=O)cccc2(N+)(=O)(O)
STK062568
ZINC000004808788
ZINC04808788
ZINC4808788

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Available files

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