Vitas-M small molecule compound

1-benzofuran-2-yl[4-(4-nitrophenyl)piperazin-1-yl]methanone

Catalog ID
STK396745
SMILES O=C(c1cc2c(o1)cccc2)N1CCN(CC1)c1ccc(cc1)[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 C19H17N3O4 MW 351.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O4/c23-19(18-13-14-3-1-2-4-17(14)26-18)21-11-9-20(10-12-21)15-5-7-16(8-6-15)22(24)25/h1-8,13H,9-12H2
InChIKey
RRPAWVRLDCZSHH-UHFFFAOYSA-N
Synonyms

1benzofuran2yl(4(4nitrophenyl)piperazin1yl)methanone
BENZO(D)FURAN2YL4(4NITROPHENYL)PIPERAZINYLKETONE
C1CN(CCN1C2=CC=C(C=C2)(N+)(=O)(O))C(=O)C3=CC4=CC=CC=C4O3
InChI=1SC19H17N3O4c2319(181314312417(14)2618)2111920(101221)155716(8615)22(24)25h1813H912H2
MFCD02187713
O=C(c1cc2c(o1)cccc2)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
ZINC000003904040
ZINC03904040
ZINC3904040

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Available files

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