Vitas-M small molecule compound

azepan-1-yl[4-(2-chloro-4-nitrophenoxy)phenyl]methanone

Catalog ID
STK240037
SMILES Clc1cc(ccc1Oc1ccc(cc1)C(=O)N1CCCCCC1)[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 C19H19ClN2O4 MW 374.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O4/c20-17-13-15(22(24)25)7-10-18(17)26-16-8-5-14(6-9-16)19(23)21-11-3-1-2-4-12-21/h5-10,13H,1-4,11-12H2
InChIKey
RWJVDMJOUZOKNO-UHFFFAOYSA-N
Synonyms
693832-51-8
693832518
azepan1yl(4(2chloro4nitrophenoxy)phenyl)methanone
C1CCCN(CC1)C(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3)(N+)(=O)(O))Cl
Clc1cc(ccc1Oc1ccc(cc1)C(=O)N1CCCCCC1)(N+)(=O)(O)
InChI=1SC19H19ClN2O4c20171315(22(24)25)71018(17)26168514(6916)19(23)211131241221h51013H141112H2
MFCD04211120
ZINC000001140838
ZINC01140838
ZINC1140838

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Available files

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