Vitas-M small molecule compound

pentyl 2-(3-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK267738
SMILES CCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)[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 C20H18N2O6 MW 382.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O6/c1-2-3-4-10-28-20(25)13-8-9-16-17(11-13)19(24)21(18(16)23)14-6-5-7-15(12-14)22(26)27/h5-9,11-12H,2-4,10H2,1H3
InChIKey
YAJQXULTVQFHOR-UHFFFAOYSA-N
Synonyms

CCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC(=CC=C3)(N+)(=O)(O)
CCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC20H18N2O6c1234102820(25)13891617(1113)19(24)21(18(16)23)1465715(1214)22(26)27h591112H2410H21H3
MFCD00596427
pentyl2(3nitrophenyl)13dioxo23dihydro1Hisoindole5carboxylate
PENTYL2(3NITROPHENYL)13DIOXOBENZO(C)AZOLINE5CARBOXYLATE
PENTYL2(3NITROPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
ZINC000002485701
ZINC02485701
ZINC2485701

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Available files

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