Vitas-M small molecule compound

1-(2,3-dimethylphenyl)-4-(3-nitrobenzyl)piperazine

Catalog ID
STK120252
SMILES [O-][N+](=O)c1cccc(c1)CN1CCN(CC1)c1cccc(c1C)C

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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 C19H23N3O2 MW 325.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O2/c1-15-5-3-8-19(16(15)2)21-11-9-20(10-12-21)14-17-6-4-7-18(13-17)22(23)24/h3-8,13H,9-12,14H2,1-2H3
InChIKey
AEHLQHIGYPNBIT-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cccc(c1)CN1CCN(CC1)c1cccc(c1C)C
1(23DIMETHYLPHENYL)4((3NITROPHENYL)METHYL)PIPERAZINE
1(23DIMETHYLPHENYL)4(3NITROBENZYL)PIPERAZINE
CC1=C(C(=CC=C1)N2CCN(CC2)CC3=CC(=CC=C3)(N+)(=O)(O))C
InChI=1SC19H23N3O2c11553819(16(15)2)2111920(101221)141764718(1317)22(23)24h3813H91214H212H3
MFCD00976473
ZINC000055543315
ZINC55543315

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Available files

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