Vitas-M small molecule compound

ethyl 5-{[(4-ethoxy-3-nitrophenyl)carbonyl]amino}-2-(morpholin-4-yl)benzoate

Catalog ID
STK188744
SMILES CCOC(=O)c1cc(ccc1N1CCOCC1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])OCC

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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 C22H25N3O7 MW 443.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O7/c1-3-31-20-8-5-15(13-19(20)25(28)29)21(26)23-16-6-7-18(24-9-11-30-12-10-24)17(14-16)22(27)32-4-2/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,23,26)
InChIKey
ZMGCXUBNFFAMNN-UHFFFAOYSA-N
Synonyms

CCOC(=O)c1cc(ccc1N1CCOCC1)NC(=O)c1ccc(c(c1)(N+)(=O)(O))OCC
CCOC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCOCC3)C(=O)OCC)(N+)(=O)(O)
ETHYL5(((4ETHOXY3NITROPHENYL)CARBONYL)AMINO)2(MORPHOLIN4YL)BENZOATE
ethyl5((4ethoxy3nitrobenzoyl)amino)2morpholin4ylbenzoate
InChI=1SC22H25N3O7c1331208515(1319(20)25(28)29)21(26)23166718(2491130121024)17(1416)22(27)3242h581314H34912H212H3(H2326)
MFCD06664842
ZINC000009907792
ZINC09907792
ZINC9907792

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Available files

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