Vitas-M small molecule compound
diethyl N-[(5-nitro-1H-imidazol-4-yl)carbonyl]aspartate
Catalog ID
STK806414
SMILES CCOC(=O)C(NC(=O)c1nc[nH]c1[N+](=O)[O-])CC(=O)OCC
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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 C12H16N4O7 MW 328.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N4O7/c1-3-22-8(17)5-7(12(19)23-4-2)15-11(18)9-10(16(20)21)14-6-13-9/h6-7H,3-5H2,1-2H3,(H,13,14)(H,15,18)InChIKey
SWRNPPNDMCHMOG-UHFFFAOYSA-NSynonyms
197912-20-2197912202
ASPARTICACIDN((5NITRO1HIMIDAZOL4YL)CARBONYL)DIETHYLESTER
CCOC(=O)C(NC(=O)c1nc(nH)c1(N+)(=O)(O))CC(=O)OCC
CCOC(=O)CC(C(=O)OCC)NC(=O)C1=C(N=CN1)(N+)(=O)(O)
DIETHYL2(((5(HYDROXY(OXIDO)AMINO)1HIMIDAZOL4YL)CARBONYL)AMINO)SUCCINATE
DIETHYL2((4NITRO1HIMIDAZOLE5CARBONYL)AMINO)BUTANEDIOATE
DIETHYL2((5NITRO1HIMIDAZOLE4CARBONYL)AMINO)BUTANEDIOATE
diethyl2(5nitro1Himidazole4carboxamido)succinate
diethylN((5nitro1Himidazol4yl)carbonyl)aspartate
InChI=1SC12H16N4O7c13228(17)57(12(19)2342)1511(18)910(16(20)21)146139h67H35H212H3(H1314)(H1518)
MFCD01435684
ZINC000009327440
ZINC000009339450
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