Vitas-M small molecule compound
2-(3-chloro-4-methylphenyl)-5-nitro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK268082
SMILES O=C1c2cc(ccc2C(=O)N1c1ccc(c(c1)Cl)C)[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 C15H9ClN2O4 MW 316.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H9ClN2O4/c1-8-2-3-9(7-13(8)16)17-14(19)11-5-4-10(18(21)22)6-12(11)15(17)20/h2-7H,1H3InChIKey
JKPGDXKNVGDKIO-UHFFFAOYSA-NSynonyms
2(3chloro4methylphenyl)5nitro1Hisoindole13(2H)dione
2(3CHLORO4METHYLPHENYL)5NITROISOINDOLE13DIONE
CC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)(N+)(=O)(O))Cl
InChI=1SC15H9ClN2O4c18239(713(8)16)1714(19)115410(18(21)22)612(11)15(17)20h27H1H3
MFCD01046639
O=C1c2cc(ccc2C(=O)N1c1ccc(c(c1)Cl)C)(N+)(=O)(O)
ZINC000000064093
ZINC00064093
ZINC64093
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