Vitas-M small molecule compound
N-(4-methyl-2-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Catalog ID
STK850102
SMILES O=C(C1COc2c(O1)cccc2)Nc1ccc(cc1[N+](=O)[O-])C
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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 C16H14N2O5 MW 314.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O5/c1-10-6-7-11(12(8-10)18(20)21)17-16(19)15-9-22-13-4-2-3-5-14(13)23-15/h2-8,15H,9H2,1H3,(H,17,19)InChIKey
YFYWCKDAYSLMJI-UHFFFAOYSA-NSynonyms
452926-00-02H3HBENZO(E)14DIOXIN2YLN(4METHYL2NITROPHENYL)CARBOXAMIDE
452926000
CC1=CC(=C(C=C1)NC(=O)C2COC3=CC=CC=C3O2)(N+)(=O)(O)
InChI=1SC16H14N2O5c1106711(12(810)18(20)21)1716(19)1592213423514(13)2315h2815H9H21H3(H1719)
MFCD02362817
N(4methyl2nitrophenyl)23dihydro14benzodioxine2carboxamide
N(4methyl2nitrophenyl)23dihydro14benzodioxine3carboxamide
N(4METHYL2NITROPHENYL)23DIHYDROBENZO(B)(14)DIOXINE2CARBOXAMIDE
O=C(C1COc2c(O1)cccc2)Nc1ccc(cc1(N+)(=O)(O))C
ZINC000004291932
ZINC000004291933
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