Vitas-M small molecule compound

(4-nitrophenyl){4-[(3,4,5-trimethoxyphenyl)carbonyl]piperazin-1-yl}methanone

Catalog ID
STK128042
SMILES COc1cc(cc(c1OC)OC)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 C21H23N3O7 MW 429.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O7/c1-29-17-12-15(13-18(30-2)19(17)31-3)21(26)23-10-8-22(9-11-23)20(25)14-4-6-16(7-5-14)24(27)28/h4-7,12-13H,8-11H2,1-3H3
InChIKey
WWHRKERPLWEMNJ-UHFFFAOYSA-N
Synonyms
333757-74-7
(4(4NITROBENZOYL)PIPERAZIN1YL)(345TRIMETHOXYPHENYL)METHANONE
(4NITROPHENYL)(4((345TRIMETHOXYPHENYL)CARBONYL)PIPERAZIN1YL)METHANONE
(4nitrophenyl)(4(345trimethoxybenzoyl)piperazin1yl)methanone
333757747
COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)(N+)(=O)(O)
COc1cc(cc(c1OC)OC)C(=O)N1CCN(CC1)C(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC21H23N3O7c129171215(1318(302)19(17)313)21(26)2310822(91123)20(25)144616(7514)24(27)28h471213H811H213H3
MFCD02374639
ZINC000000893220
ZINC00893220
ZINC893220

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Available files

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