Vitas-M small molecule compound

N-(4-methyl-3-nitrophenyl)-1,3-benzodioxole-5-carboxamide

Catalog ID
STK421692
SMILES O=C(c1ccc2c(c1)OCO2)Nc1ccc(c(c1)[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 C15H12N2O5 MW 300.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N2O5/c1-9-2-4-11(7-12(9)17(19)20)16-15(18)10-3-5-13-14(6-10)22-8-21-13/h2-7H,8H2,1H3,(H,16,18)
InChIKey
HPFKSIXDSCTNMZ-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3)(N+)(=O)(O)
InChI=1SC15H12N2O5c192411(712(9)17(19)20)1615(18)10351314(610)2282113h27H8H21H3(H1618)
MFCD01345346
N(3NITRO4METHYLPHENYL)13BENZODIOXOLE5CARBOXAMIDE
N(4methyl3nitrophenyl)13benzodioxole5carboxamide
O=C(c1ccc2c(c1)OCO2)Nc1ccc(c(c1)(N+)(=O)(O))C
ZINC000002736869
ZINC02736869
ZINC2736869

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Available files

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