Vitas-M small molecule compound
4-{[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl}-7-methyl-2-oxo-2H-chromen-5-olate
Catalog ID
STK579246
SMILES COc1ccc(cc1)N1CC[NH+](CC1)Cc1cc(=O)oc2c1c([O-])cc(c2)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 C22H24N2O4 MW 380.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O4/c1-15-11-19(25)22-16(13-21(26)28-20(22)12-15)14-23-7-9-24(10-8-23)17-3-5-18(27-2)6-4-17/h3-6,11-13,25H,7-10,14H2,1-2H3InChIKey
DQXBANHXTGPONS-UHFFFAOYSA-NSynonyms
896807-19-54((4(4methoxyphenyl)piperazin1ium1yl)methyl)7methyl2oxo2Hchromen5olate
5HYDROXY4((4(4METHOXYPHENYL)PIPERAZIN1YL)METHYL)7METHYLCHROMEN2ONE
5HYDROXY4((4(4METHOXYPHENYL)PIPERAZINYL)METHYL)7METHYLCHROMEN2ONE
CC1=CC2=C(C(=CC(=O)O2)CN3CCN(CC3)C4=CC=C(C=C4)OC)C(=C1)O
COc1ccc(cc1)N1CC(NH+)(CC1)Cc1cc(=O)oc2c1c((O))cc(c2)C
InChI=1SC22H24N2O4c1151119(25)2216(1321(26)2820(22)1215)14237924(10823)173518(272)6417h36111325H71014H212H3
MFCD06595604
ZINC000095481516
ZINC95481516
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