Vitas-M small molecule compound
3-{[4-(3,4-dimethylphenyl)piperazin-1-yl]carbonyl}-6-nitro-2H-chromen-2-one
Catalog ID
STK771909
SMILES O=C(c1cc2cc(ccc2oc1=O)[N+](=O)[O-])N1CCN(CC1)c1ccc(c(c1)C)C
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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 C22H21N3O5 MW 407.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O5/c1-14-3-4-17(11-15(14)2)23-7-9-24(10-8-23)21(26)19-13-16-12-18(25(28)29)5-6-20(16)30-22(19)27/h3-6,11-13H,7-10H2,1-2H3InChIKey
VWZBGJXVXKXYPM-UHFFFAOYSA-NSynonyms
682346-06-13((4(34dimethylphenyl)piperazin1yl)carbonyl)6nitro2Hchromen2one
3(4(34DIMETHYLPHENYL)PIPERAZINE1CARBONYL)6NITRO2HCHROMEN2ONE
3(4(34DIMETHYLPHENYL)PIPERAZINE1CARBONYL)6NITROCHROMEN2ONE
682346061
CC1=C(C=C(C=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=CC(=C4)(N+)(=O)(O))OC3=O)C
InChI=1SC22H21N3O5c1143417(1115(14)2)237924(10823)21(26)1913161218(25(28)29)5620(16)3022(19)27h361113H710H212H3
MFCD03767814
O=C(c1cc2cc(ccc2oc1=O)(N+)(=O)(O))N1CCN(CC1)c1ccc(c(c1)C)C
ZINC000001075319
ZINC01075319
ZINC1075319
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