Vitas-M small molecule compound
N-[2-(azepan-1-ylcarbonyl)phenyl]-4-methyl-3-nitrobenzamide
Catalog ID
STL285387
SMILES O=C(c1ccccc1NC(=O)c1ccc(c(c1)[N+](=O)[O-])C)N1CCCCCC1
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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 C21H23N3O4 MW 381.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O4/c1-15-10-11-16(14-19(15)24(27)28)20(25)22-18-9-5-4-8-17(18)21(26)23-12-6-2-3-7-13-23/h4-5,8-11,14H,2-3,6-7,12-13H2,1H3,(H,22,25)InChIKey
LOSGCSXGUCYVCK-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)(N+)(=O)(O)
InChI=1SC21H23N3O4c115101116(1419(15)24(27)28)20(25)2218954817(18)21(26)231262371323h4581114H23671213H21H3(H2225)
MFCD07360146
N(2(azepan1ylcarbonyl)phenyl)4methyl3nitrobenzamide
N(2(AZEPANE1CARBONYL)PHENYL)4METHYL3NITROBENZAMIDE
O=C(c1ccccc1NC(=O)c1ccc(c(c1)(N+)(=O)(O))C)N1CCCCCC1
ZINC000004840374
ZINC04840374
ZINC4840374
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