Vitas-M small molecule compound
6-ethyl-2-oxo-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2H-chromen-7-olate
Catalog ID
STK597131
SMILES CCc1cc2c(cc1[O-])oc(=O)cc2C[NH+]1CCN(CC1)c1ccccc1
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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 C22H24N2O3 MW 364.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O3/c1-2-16-12-19-17(13-22(26)27-21(19)14-20(16)25)15-23-8-10-24(11-9-23)18-6-4-3-5-7-18/h3-7,12-14,25H,2,8-11,15H2,1H3InChIKey
WANJRVGPCQQVMB-UHFFFAOYSA-NSynonyms
849191-76-06ethyl2oxo4((4phenylpiperazin1ium1yl)methyl)2Hchromen7olate
6ethyl2oxo4((4phenylpiperazin1ium1yl)methyl)chromen7olate
CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C(NH+)3CCN(CC3)C4=CC=CC=C4)(O)
CCc1cc2c(cc1(O))oc(=O)cc2C(NH+)1CCN(CC1)c1ccccc1
InChI=1SC22H24N2O3c1216121917(1322(26)2721(19)1420(16)25)152381024(11923)186435718h37121425H281115H21H3
MFCD06592793
ZINC000054147531
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