Vitas-M small molecule compound
methyl 2-({[3-nitro-4-(piperidin-1-yl)phenyl]carbonyl}amino)benzoate
Catalog ID
STK323802
SMILES COC(=O)c1ccccc1NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCCCC1
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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 C20H21N3O5 MW 383.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O5/c1-28-20(25)15-7-3-4-8-16(15)21-19(24)14-9-10-17(18(13-14)23(26)27)22-11-5-2-6-12-22/h3-4,7-10,13H,2,5-6,11-12H2,1H3,(H,21,24)InChIKey
FUDCQRMSIKGWTM-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)N3CCCCC3)(N+)(=O)(O)
COC(=O)c1ccccc1NC(=O)c1ccc(c(c1)(N+)(=O)(O))N1CCCCC1
InChI=1SC20H21N3O5c12820(25)15734816(15)2119(24)1491017(18(1314)23(26)27)22115261222h3471013H2561112H21H3(H2124)
methyl2(((3nitro4(piperidin1yl)phenyl)carbonyl)amino)benzoate
METHYL2((3NITRO4PIPERIDIN1YLBENZOYL)AMINO)BENZOATE
METHYL2((3NITRO4PIPERIDYLPHENYL)CARBONYLAMINO)BENZOATE
MFCD05810833
ZINC000005028007
ZINC05028007
ZINC5028007
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