Vitas-M small molecule compound

N-[2-(3,4-diethoxyphenyl)ethyl]-2-(morpholin-4-yl)-5-nitrobenzamide

Catalog ID
STK766532
SMILES CCOc1cc(CCNC(=O)c2cc(ccc2N2CCOCC2)[N+](=O)[O-])ccc1OCC

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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 C23H29N3O6 MW 443.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O6/c1-3-31-21-8-5-17(15-22(21)32-4-2)9-10-24-23(27)19-16-18(26(28)29)6-7-20(19)25-11-13-30-14-12-25/h5-8,15-16H,3-4,9-14H2,1-2H3,(H,24,27)
InChIKey
YKEXKMBRCRRYAL-UHFFFAOYSA-N
Synonyms

CCOC1=C(C=C(C=C1)CCNC(=O)C2=C(C=CC(=C2)(N+)(=O)(O))N3CCOCC3)OCC
CCOc1cc(CCNC(=O)c2cc(ccc2N2CCOCC2)(N+)(=O)(O))ccc1OCC
InChI=1SC23H29N3O6c1331218517(1522(21)3242)9102423(27)191618(26(28)29)6720(19)25111330141225h581516H34914H212H3(H2427)
MFCD03017771
N(2(34diethoxyphenyl)ethyl)2(morpholin4yl)5nitrobenzamide
N(2(34DIETHOXYPHENYL)ETHYL)2MORPHOLIN4YL5NITROBENZAMIDE
ZINC000008846636
ZINC08846636
ZINC8846636

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Available files

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