Vitas-M small molecule compound
N-(4-nitrophenyl)azepane-1-carboxamide
Catalog ID
STK459590
SMILES O=C(N1CCCCCC1)Nc1ccc(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 C13H17N3O3 MW 263.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3O3/c17-13(15-9-3-1-2-4-10-15)14-11-5-7-12(8-6-11)16(18)19/h5-8H,1-4,9-10H2,(H,14,17)InChIKey
YYOHHSLXMDWRGO-UHFFFAOYSA-NSynonyms
AZAPERHYDROEPINYLN(4NITROPHENYL)CARBOXAMIDE
C1CCCN(CC1)C(=O)NC2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC13H17N3O3c1713(15931241015)14115712(8611)16(18)19h58H14910H2(H1417)
MFCD01348447
N(4nitrophenyl)azepane1carboxamide
O=C(N1CCCCCC1)Nc1ccc(cc1)(N+)(=O)(O)
ZINC000005060746
ZINC05060746
ZINC5060746
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