Vitas-M small molecule compound

(3-methoxyphenyl)[4-(3-nitrobenzyl)piperazin-1-yl]methanone

Catalog ID
STK129914
SMILES COc1cccc(c1)C(=O)N1CCN(CC1)Cc1cccc(c1)[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 C19H21N3O4 MW 355.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O4/c1-26-18-7-3-5-16(13-18)19(23)21-10-8-20(9-11-21)14-15-4-2-6-17(12-15)22(24)25/h2-7,12-13H,8-11,14H2,1H3
InChIKey
PFXKHBXHSOHPTO-UHFFFAOYSA-N
Synonyms
(3METHOXYPHENYL)(4((3NITROPHENYL)METHYL)PIPERAZIN1YL)METHANONE
(3METHOXYPHENYL)(4(3NITROBENZYL)PIPERAZIN1YL)METHANONE
1((3NITROPHENYL)METHYL)4((3(METHYLOXY)PHENYL)CARBONYL)PIPERAZINE
COC1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=CC(=CC=C3)(N+)(=O)(O)
COc1cccc(c1)C(=O)N1CCN(CC1)Cc1cccc(c1)(N+)(=O)(O)
Registry IDs
MFCD01816428
ZINC000019773814
ZINC19773814

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Available files

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