Vitas-M small molecule compound
6-chloro-4-{[4-(ethoxycarbonyl)piperazin-1-ium-1-yl]methyl}-2-oxo-2H-chromen-7-olate
Catalog ID
STK579174
SMILES CCOC(=O)N1CC[NH+](CC1)Cc1cc(=O)oc2c1cc(Cl)c(c2)[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 C17H19ClN2O5 MW 366.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19ClN2O5/c1-2-24-17(23)20-5-3-19(4-6-20)10-11-7-16(22)25-15-9-14(21)13(18)8-12(11)15/h7-9,21H,2-6,10H2,1H3InChIKey
ABEZMYCAMQCYLO-UHFFFAOYSA-NSynonyms
877800-39-06chloro4((4(ethoxycarbonyl)piperazin1ium1yl)methyl)2oxo2Hchromen7olate
CCOC(=O)N1CC(NH+)(CC1)Cc1cc(=O)oc2c1cc(Cl)c(c2)(O)
CCOC(=O)N1CCN(CC1)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)O
ETHYL4((6CHLORO7HYDROXY2OXOCHROMEN4YL)METHYL)PIPERAZINE1CARBOXYLATE
ETHYL4((6CHLORO7HYDROXY2OXOCHROMEN4YL)METHYL)PIPERAZINECARBOXYLATE
InChI=1SC17H19ClN2O5c122417(23)205319(4620)1011716(22)2515914(21)13(18)812(11)15h7921H2610H21H3
MFCD05703927
ZINC000020502746
ZINC20502746
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