Vitas-M small molecule compound

N-(4-chloro-9,10-dioxo-9,10-dihydroanthracen-1-yl)-4-(hexyloxy)-3-nitrobenzamide

Catalog ID
STK087132
SMILES CCCCCCOc1ccc(cc1[N+](=O)[O-])C(=O)Nc1ccc(c2c1C(=O)c1ccccc1C2=O)Cl

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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 C27H23ClN2O6 MW 506.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23ClN2O6/c1-2-3-4-7-14-36-22-13-10-16(15-21(22)30(34)35)27(33)29-20-12-11-19(28)23-24(20)26(32)18-9-6-5-8-17(18)25(23)31/h5-6,8-13,15H,2-4,7,14H2,1H3,(H,29,33)
InChIKey
ZOZGNPCWLIAVBP-UHFFFAOYSA-N
Synonyms

CCCCCCOC1=C(C=C(C=C1)C(=O)NC2=C3C(=C(C=C2)Cl)C(=O)C4=CC=CC=C4C3=O)(N+)(=O)(O)
CCCCCCOc1ccc(cc1(N+)(=O)(O))C(=O)Nc1ccc(c2c1C(=O)c1ccccc1C2=O)Cl
InChI=1SC27H23ClN2O6c12347143622131016(1521(22)30(34)35)27(33)2920121119(28)2324(20)26(32)18965817(18)25(23)31h5681315H24714H21H3(H2933)
MFCD00610079
N(4CHLORO910DIOXO910DIHYDROANTHRACEN1YL)4(HEXYLOXY)3NITROBENZAMIDE
N(4CHLORO910DIOXOANTHRACEN1YL)4HEXOXY3NITROBENZAMIDE
STK087132
ZINC000009704313
ZINC09704313
ZINC9704313

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.