Vitas-M small molecule compound
methyl 2-(4-benzylpiperazin-1-yl)-5-nitrobenzoate
Catalog ID
STK531489
SMILES COC(=O)c1cc(ccc1N1CCN(CC1)Cc1ccccc1)[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/c1-26-19(23)17-13-16(22(24)25)7-8-18(17)21-11-9-20(10-12-21)14-15-5-3-2-4-6-15/h2-8,13H,9-12,14H2,1H3InChIKey
YLJPMKACPODZQU-UHFFFAOYSA-NSynonyms
381195-04-6381195046
COC(=O)C1=C(C=CC(=C1)(N+)(=O)(O))N2CCN(CC2)CC3=CC=CC=C3
COC(=O)c1cc(ccc1N1CCN(CC1)Cc1ccccc1)(N+)(=O)(O)
InChI=1SC19H21N3O4c12619(23)171316(22(24)25)7818(17)2111920(101221)14155324615h2813H91214H21H3
METHYL2(4BENZYL1PIPERAZINYL)5NITROBENZOATE
methyl2(4benzylpiperazin1yl)5nitrobenzoate
METHYL2(4BENZYLPIPERAZINO)5NITROBENZENECARBOXYLATE
METHYLBENZYLPIPERAZINONITROBENZENECARBOXYLATE
MFCD02643034
ZINC000055491787
ZINC55491787
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