Vitas-M small molecule compound
N-(2-chloro-5-methyl-4-nitrophenyl)-1,3-benzodioxole-5-carboxamide
Catalog ID
STK319913
SMILES O=C(c1ccc2c(c1)OCO2)Nc1cc(C)c(cc1Cl)[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 C15H11ClN2O5 MW 334.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11ClN2O5/c1-8-4-11(10(16)6-12(8)18(20)21)17-15(19)9-2-3-13-14(5-9)23-7-22-13/h2-6H,7H2,1H3,(H,17,19)InChIKey
KGPMTVQRSIVMGG-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1(N+)(=O)(O))Cl)NC(=O)C2=CC3=C(C=C2)OCO3
InChI=1SC15H11ClN2O5c18411(10(16)612(8)18(20)21)1715(19)9231314(59)2372213h26H7H21H3(H1719)
MFCD09961490
N(2chloro5methyl4nitrophenyl)13benzodioxole5carboxamide
O=C(c1ccc2c(c1)OCO2)Nc1cc(C)c(cc1Cl)(N+)(=O)(O)
ZINC000012651666
ZINC12651666
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