Vitas-M small molecule compound
N-(2-methoxy-4-nitrophenyl)azepane-1-carboxamide
Catalog ID
STK461290
SMILES COc1cc(ccc1NC(=O)N1CCCCCC1)[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 C14H19N3O4 MW 293.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19N3O4/c1-21-13-10-11(17(19)20)6-7-12(13)15-14(18)16-8-4-2-3-5-9-16/h6-7,10H,2-5,8-9H2,1H3,(H,15,18)InChIKey
PQSBQLLYBIPIEH-UHFFFAOYSA-NSynonyms
AZAPERHYDROEPINYLN(2METHOXY4NITROPHENYL)CARBOXAMIDE
COC1=C(C=CC(=C1)(N+)(=O)(O))NC(=O)N2CCCCCC2
COc1cc(ccc1NC(=O)N1CCCCCC1)(N+)(=O)(O)
InChI=1SC14H19N3O4c121131011(17(19)20)6712(13)1514(18)1684235916h6710H2589H21H3(H1518)
MFCD05991777
N(2methoxy4nitrophenyl)azepane1carboxamide
ZINC000005062947
ZINC05062947
ZINC5062947
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