Vitas-M small molecule compound

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

Catalog ID
STK188754
SMILES CCOC(=O)c1cc(ccc1N1CCOCC1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])C

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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 C21H23N3O6 MW 413.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O6/c1-3-30-21(26)17-13-16(6-7-18(17)23-8-10-29-11-9-23)22-20(25)15-5-4-14(2)19(12-15)24(27)28/h4-7,12-13H,3,8-11H2,1-2H3,(H,22,25)
InChIKey
URDBXHOOYURNCV-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2)C)(N+)(=O)(O))N3CCOCC3
CCOC(=O)c1cc(ccc1N1CCOCC1)NC(=O)c1ccc(c(c1)(N+)(=O)(O))C
ETHYL5(((4METHYL3NITROPHENYL)CARBONYL)AMINO)2(MORPHOLIN4YL)BENZOATE
ETHYL5((4METHYL3NITROBENZOYL)AMINO)2MORPHOLIN4YLBENZOATE
InChI=1SC21H23N3O6c133021(26)171316(6718(17)238102911923)2220(25)155414(2)19(1215)24(27)28h471213H3811H212H3(H2225)
MFCD06664852
ZINC000004711561
ZINC04711561
ZINC4711561

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Available files

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