Vitas-M small molecule compound
2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5-nitrobenzaldehyde
Catalog ID
STK594386
SMILES O=Cc1cc(ccc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)[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 C19H19N3O5 MW 369.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O5/c23-12-15-10-16(22(24)25)2-3-17(15)21-7-5-20(6-8-21)11-14-1-4-18-19(9-14)27-13-26-18/h1-4,9-10,12H,5-8,11,13H2InChIKey
ALOTVOANVRBLLQ-UHFFFAOYSA-NSynonyms
900260-84-62(4(13benzodioxol5ylmethyl)piperazin1yl)5nitrobenzaldehyde
2(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)5nitrobenzaldehyde
900260846
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=C(C=C(C=C4)(N+)(=O)(O))C=O
InChI=1SC19H19N3O5c2312151016(22(24)25)2317(15)217520(6821)1114141819(914)27132618h1491012H581113H2
MFCD06774552
O=Cc1cc(ccc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)(N+)(=O)(O)
ZINC000057122062
ZINC57122062
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