Vitas-M small molecule compound

(4-benzylpiperidin-1-yl)(3-methyl-4-nitrophenyl)methanone

Catalog ID
STK078577
SMILES O=C(c1ccc(c(c1)C)[N+](=O)[O-])N1CCC(CC1)Cc1ccccc1

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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 C20H22N2O3 MW 338.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O3/c1-15-13-18(7-8-19(15)22(24)25)20(23)21-11-9-17(10-12-21)14-16-5-3-2-4-6-16/h2-8,13,17H,9-12,14H2,1H3
InChIKey
HHAXOJSXKKSRLX-UHFFFAOYSA-N
Synonyms
325811-46-9
(3METHYL4NITROPHENYL)(4(PHENYLMETHYL)1PIPERIDINYL)METHANONE
(3METHYL4NITROPHENYL)(4(PHENYLMETHYL)PIPERIDIN1YL)METHANONE
(4BENZYLPIPERIDIN1YL)(3METHYL4NITROPHENYL)METHANONE
(4BENZYLPIPERIDINO)(3METHYL4NITROPHENYL)METHANONE
325811469
3METHYL4NITROPHENYL4BENZYLPIPERIDYLKETONE
4BENZYL1(3METHYL4NITROBENZOYL)PIPERIDINE
CC1=C(C=CC(=C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)(N+)(=O)(O)
InChI=1SC20H22N2O3c1151318(7819(15)22(24)25)20(23)2111917(101221)14165324616h281317H91214H21H3
MFCD01216594
O=C(c1ccc(c(c1)C)(N+)(=O)(O))N1CCC(CC1)Cc1ccccc1
STK078577
ZINC000000284816
ZINC00284816
ZINC284816

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Available files

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