Vitas-M small molecule compound
[4-(3,4-dimethoxybenzyl)piperazin-1-yl](4-nitrophenyl)methanone
Catalog ID
STK146842
SMILES COc1ccc(cc1OC)CN1CCN(CC1)C(=O)c1ccc(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 C20H23N3O5 MW 385.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O5/c1-27-18-8-3-15(13-19(18)28-2)14-21-9-11-22(12-10-21)20(24)16-4-6-17(7-5-16)23(25)26/h3-8,13H,9-12,14H2,1-2H3InChIKey
SRDIPPDXIFGILW-UHFFFAOYSA-NSynonyms
(4((34dimethoxyphenyl)methyl)piperazin1yl)(4nitrophenyl)methanone
(4(34DIMETHOXYBENZYL)PIPERAZIN1YL)(4NITROPHENYL)METHANONE
COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)(N+)(=O)(O))OC
COc1ccc(cc1OC)CN1CCN(CC1)C(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H23N3O5c127188315(1319(18)282)142191122(121021)20(24)164617(7516)23(25)26h3813H91214H212H3
MFCD01829953
ZINC000019561059
ZINC19561059
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