Vitas-M small molecule compound

(3,4-dimethoxyphenyl){4-[(4-nitrophenyl)carbonyl]piperazin-1-yl}methanone

Catalog ID
STK128366
SMILES COc1cc(ccc1OC)C(=O)N1CCN(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 C20H21N3O6 MW 399.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O6/c1-28-17-8-5-15(13-18(17)29-2)20(25)22-11-9-21(10-12-22)19(24)14-3-6-16(7-4-14)23(26)27/h3-8,13H,9-12H2,1-2H3
InChIKey
XTLAKOURZMFVAZ-UHFFFAOYSA-N
Synonyms
423732-62-1
(34DIMETHOXYPHENYL)(4((4NITROPHENYL)CARBONYL)PIPERAZIN1YL)METHANONE
(34DIMETHOXYPHENYL)(4(4NITROBENZOYL)PIPERAZIN1YL)METHANONE
(4(34dimethoxybenzoyl)piperazin1yl)(4nitrophenyl)methanone
423732621
COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)(N+)(=O)(O))OC
COc1cc(ccc1OC)C(=O)N1CCN(CC1)C(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H21N3O6c128178515(1318(17)292)20(25)2211921(101222)19(24)143616(7414)23(26)27h3813H912H212H3
MFCD02212032
ZINC000000893127
ZINC00893127
ZINC893127

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Available files

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