Vitas-M small molecule compound
4-butyl-6-chloro-8-[(diethylammonio)methyl]-2-oxo-2H-chromen-7-olate
Catalog ID
STL048632
SMILES CCCCc1cc(=O)oc2c1cc(Cl)c(c2C[NH+](CC)CC)[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 C18H24ClNO3 MW 337.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24ClNO3/c1-4-7-8-12-9-16(21)23-18-13(12)10-15(19)17(22)14(18)11-20(5-2)6-3/h9-10,22H,4-8,11H2,1-3H3InChIKey
UHNOHCDBXDQTMX-UHFFFAOYSA-NSynonyms
692747-19-64BUTYL6CHLORANYL8(DIETHYLAMINOMETHYL)7OXIDANYLCHROMEN2ONE
4BUTYL6CHLORO8((DIETHYLAMINO)METHYL)7HYDROXY2HCHROMEN2ONE
4butyl6chloro8((diethylammonio)methyl)2oxo2Hchromen7olate
4BUTYL6CHLORO8((DIETHYLAZANIUMYL)METHYL)2OXOCHROMEN7OLATE
4BUTYL6CHLORO8(DIETHYLAMINOMETHYL)7HYDROXY1BENZOPYRAN2ONE
4BUTYL6CHLORO8(DIETHYLAMINOMETHYL)7HYDROXYCHROMEN2ONE
4BUTYL6CHLORO8(DIETHYLAMINOMETHYL)7HYDROXYCOUMARIN
4BUTYL6CHLORO8DIETHYLAMINOMETHYL7HYDROXYCHROMEN2ONE
692747196
CCCCC1=CC(=O)OC2=C(C(=C(C=C12)Cl)(O))C(NH+)(CC)CC
CCCCc1cc(=O)oc2c1cc(Cl)c(c2C(NH+)(CC)CC)(O)
InChI=1SC18H24ClNO3c147812916(21)231813(12)1015(19)17(22)14(18)1120(52)63h91022H4811H213H3
MFCD04161038
ZINC000019911595
ZINC19911595
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