Vitas-M small molecule compound

(3-ethoxyphenyl)[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]methanone

Catalog ID
STK355473
SMILES CCOc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])OC

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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 C20H23N3O5 MW 385.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O5/c1-3-28-17-6-4-5-15(13-17)20(24)22-11-9-21(10-12-22)18-8-7-16(27-2)14-19(18)23(25)26/h4-8,13-14H,3,9-12H2,1-2H3
InChIKey
SIEHOBXZKDEEAC-UHFFFAOYSA-N
Synonyms

(3ethoxyphenyl)(4(4methoxy2nitrophenyl)piperazin1yl)methanone
CCOC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)OC)(N+)(=O)(O)
CCOc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))OC
InChI=1SC20H23N3O5c13281764515(1317)20(24)2211921(101222)188716(272)1419(18)23(25)26h481314H3912H212H3
MFCD07174641
ZINC000016693172
ZINC16693172

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Available files

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