Vitas-M small molecule compound
ethyl 2-(morpholin-4-yl)-5-{[(4-nitrophenyl)carbonyl]amino}benzoate
Catalog ID
STK179941
SMILES CCOC(=O)c1cc(ccc1N1CCOCC1)NC(=O)c1ccc(cc1)[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 C20H21N3O6 MW 399.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O6/c1-2-29-20(25)17-13-15(5-8-18(17)22-9-11-28-12-10-22)21-19(24)14-3-6-16(7-4-14)23(26)27/h3-8,13H,2,9-12H2,1H3,(H,21,24)InChIKey
JWXCVBBTEBPGEL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)(N+)(=O)(O))N3CCOCC3
CCOC(=O)c1cc(ccc1N1CCOCC1)NC(=O)c1ccc(cc1)(N+)(=O)(O)
ETHYL2(MORPHOLIN4YL)5(((4NITROPHENYL)CARBONYL)AMINO)BENZOATE
ETHYL2MORPHOLIN4YL5((4NITROBENZOYL)AMINO)BENZOATE
InChI=1SC20H21N3O6c122920(25)171315(5818(17)2291128121022)2119(24)143616(7414)23(26)27h3813H2912H21H3(H2124)
MFCD06664181
ZINC000004705134
ZINC04705134
ZINC4705134
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