Vitas-M small molecule compound

methyl 3-[(2-methylpiperidin-1-yl)carbonyl]-5-nitrobenzoate

Catalog ID
STK040705
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)N1CCCCC1C

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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 C15H18N2O5 MW 306.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O5/c1-10-5-3-4-6-16(10)14(18)11-7-12(15(19)22-2)9-13(8-11)17(20)21/h7-10H,3-6H2,1-2H3
InChIKey
JDUBFJGPICNMAW-UHFFFAOYSA-N
Synonyms
348604-44-4
348604444
CC1CCCCN1C(=O)C2=CC(=CC(=C2)(N+)(=O)(O))C(=O)OC
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)N1CCCCC1C
InChI=1SC15H18N2O5c110534616(10)14(18)11712(15(19)222)913(811)17(20)21h710H36H212H3
METHYL3((2METHYLPIPERIDIN1YL)CARBONYL)5NITROBENZOATE
METHYL3((2METHYLPIPERIDYL)CARBONYL)5NITROBENZOATE
METHYL3(2METHYLPIPERIDINE1CARBONYL)5NITROBENZOATE
MFCD01197001
STK040705
ZINC000000434437
ZINC000000434438

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Available files

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