Vitas-M small molecule compound
N-(2-methyl-4-nitrophenyl)azepane-1-carboxamide
Catalog ID
STK474061
SMILES O=C(N1CCCCCC1)Nc1ccc(cc1C)[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 C14H19N3O3 MW 277.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19N3O3/c1-11-10-12(17(19)20)6-7-13(11)15-14(18)16-8-4-2-3-5-9-16/h6-7,10H,2-5,8-9H2,1H3,(H,15,18)InChIKey
SOCCEUJTWLOIPT-UHFFFAOYSA-NSynonyms
AZAPERHYDROEPINYLN(2METHYL4NITROPHENYL)CARBOXAMIDE
CC1=C(C=CC(=C1)(N+)(=O)(O))NC(=O)N2CCCCCC2
InChI=1SC14H19N3O3c1111012(17(19)20)6713(11)1514(18)1684235916h6710H2589H21H3(H1518)
MFCD07612700
N(2METHYL4NITROPHENYL)AZEPANE1CARBOXAMIDE
O=C(N1CCCCCC1)Nc1ccc(cc1C)(N+)(=O)(O)
ZINC000017007752
ZINC17007752
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