Vitas-M small molecule compound

2-tert-butyl-5-[(3-nitrophenyl)carbonyl]-1H-isoindole-1,3(2H)-dione

Catalog ID
STK299837
SMILES O=C1c2cc(ccc2C(=O)N1C(C)(C)C)C(=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 C19H16N2O5 MW 352.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O5/c1-19(2,3)20-17(23)14-8-7-12(10-15(14)18(20)24)16(22)11-5-4-6-13(9-11)21(25)26/h4-10H,1-3H3
InChIKey
DMDNOFHTFPPBKZ-UHFFFAOYSA-N
Synonyms

2tertbutyl5((3nitrophenyl)carbonyl)1Hisoindole13(2H)dione
2TERTBUTYL5(3NITROBENZOYL)ISOINDOLE13DIONE
CC(C)(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC19H16N2O5c119(23)2017(23)148712(1015(14)18(20)24)16(22)1154613(911)21(25)26h410H13H3
MFCD01974804
O=C1c2cc(ccc2C(=O)N1C(C)(C)C)C(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000001150875
ZINC01150875
ZINC1150875

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Available files

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