Vitas-M small molecule compound

2-(naphthalen-2-yloxy)-1-{4-[(4-nitrophenyl)carbonyl]piperazin-1-yl}ethanone

Catalog ID
STK127393
SMILES O=C(N1CCN(CC1)C(=O)c1ccc(cc1)[N+](=O)[O-])COc1ccc2c(c1)cccc2

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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 C23H21N3O5 MW 419.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O5/c27-22(16-31-21-10-7-17-3-1-2-4-19(17)15-21)24-11-13-25(14-12-24)23(28)18-5-8-20(9-6-18)26(29)30/h1-10,15H,11-14,16H2
InChIKey
QKYJONNSQNVXAD-UHFFFAOYSA-N
Synonyms
333756-27-7
2(2NAPHTHALENYLOXY)1(4((4NITROPHENYL)OXOMETHYL)1PIPERAZINYL)ETHANONE
2(2NAPHTHOXY)1(4(4NITROBENZOYL)PIPERAZINO)ETHANONE
2(NAPHTHALEN2YLOXY)1(4((4NITROPHENYL)CARBONYL)PIPERAZIN1YL)ETHANONE
2(NAPHTHALEN2YLOXY)1(4(4NITROBENZOYL)PIPERAZIN1YL)ETHANONE
2NAPHTHALEN2YLOXY1(4(4NITROBENZOYL)PIPERAZIN1YL)ETHANONE
2NAPHTHALEN2YLOXY1(4(4NITROPHENYL)CARBONYLPIPERAZIN1YL)ETHANONE
333756277
C1CN(CCN1C(=O)COC2=CC3=CC=CC=C3C=C2)C(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC23H21N3O5c2722(16312110717312419(17)1521)24111325(141224)23(28)185820(9618)26(29)30h11015H111416H2
MFCD02212313
O=C(N1CCN(CC1)C(=O)c1ccc(cc1)(N+)(=O)(O))COc1ccc2c(c1)cccc2
ZINC000000893021
ZINC00893021
ZINC893021

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Available files

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