Vitas-M small molecule compound
3-(3-{[4-(4-nitrophenyl)piperazin-1-yl]carbonyl}phenyl)-2H-chromen-2-one
Catalog ID
STK172699
SMILES O=C(c1cccc(c1)c1cc2ccccc2oc1=O)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 C26H21N3O5 MW 455.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O5/c30-25(28-14-12-27(13-15-28)21-8-10-22(11-9-21)29(32)33)20-6-3-5-18(16-20)23-17-19-4-1-2-7-24(19)34-26(23)31/h1-11,16-17H,12-15H2InChIKey
GONSTYZFAYRWQF-UHFFFAOYSA-NSynonyms
714924-36-43(3((4(4NITROPHENYL)PIPERAZIN1YL)CARBONYL)PHENYL)2HCHROMEN2ONE
3(3(4(4nitrophenyl)piperazine1carbonyl)phenyl)2Hchromen2one
3(3(4(4NITROPHENYL)PIPERAZINE1CARBONYL)PHENYL)CHROMEN2ONE
714924364
C1CN(CCN1C2=CC=C(C=C2)(N+)(=O)(O))C(=O)C3=CC=CC(=C3)C4=CC5=CC=CC=C5OC4=O
InChI=1SC26H21N3O5c3025(28141227(131528)2181022(11921)29(32)33)2063518(1620)231719412724(19)3426(23)31h1111617H1215H2
MFCD04169030
O=C(c1cccc(c1)c1cc2ccccc2oc1=O)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
ZINC000009281788
ZINC09281788
ZINC9281788
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