Vitas-M small molecule compound

ethyl 4-[(8-methoxy-6-nitro-2-oxo-2H-chromen-3-yl)carbonyl]piperazine-1-carboxylate

Catalog ID
STK776869
SMILES CCOC(=O)N1CCN(CC1)C(=O)c1cc2cc(cc(c2oc1=O)OC)[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 C18H19N3O8 MW 405.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O8/c1-3-28-18(24)20-6-4-19(5-7-20)16(22)13-9-11-8-12(21(25)26)10-14(27-2)15(11)29-17(13)23/h8-10H,3-7H2,1-2H3
InChIKey
XJXCHJKUGDEZID-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=O)c1cc2cc(cc(c2oc1=O)OC)(N+)(=O)(O)
CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=CC(=CC(=C3OC2=O)OC)(N+)(=O)(O)
ethyl4((8methoxy6nitro2oxo2Hchromen3yl)carbonyl)piperazine1carboxylate
ETHYL4(8METHOXY6NITRO2OXOCHROMENE3CARBONYL)PIPERAZINE1CARBOXYLATE
InChI=1SC18H19N3O8c132818(24)206419(5720)16(22)13911812(21(25)26)1014(272)15(11)2917(13)23h810H37H212H3
MFCD05259706
ZINC000012413551
ZINC12413551

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.