Vitas-M small molecule compound
4-butyl-6-chloro-8-[(dimethylammonio)methyl]-2-oxo-2H-chromen-7-olate
Catalog ID
STK560875
SMILES CCCCc1cc(=O)oc2c1cc(Cl)c(c2C[NH+](C)C)[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 C16H20ClNO3 MW 309.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20ClNO3/c1-4-5-6-10-7-14(19)21-16-11(10)8-13(17)15(20)12(16)9-18(2)3/h7-8,20H,4-6,9H2,1-3H3InChIKey
VHRDZSZXCHXPTP-UHFFFAOYSA-NSynonyms
586991-87-94BUTYL6CHLORANYL8((DIMETHYLAMINO)METHYL)7OXIDANYLCHROMEN2ONE
4BUTYL6CHLORO8((DIMETHYLAMINO)METHYL)7HYDROXY1BENZOPYRAN2ONE
4BUTYL6CHLORO8((DIMETHYLAMINO)METHYL)7HYDROXYCHROMEN2ONE
4BUTYL6CHLORO8((DIMETHYLAMINO)METHYL)7HYDROXYCOUMARIN
4butyl6chloro8((dimethylammonio)methyl)2oxo2Hchromen7olate
4BUTYL6CHLORO8((DIMETHYLAZANIUMYL)METHYL)2OXOCHROMEN7OLATE
4BUTYL6CHLORO8(DIMETHYLAMINOMETHYL)7HYDROXYCHROMEN2ONE
586991879
CCCCC1=CC(=O)OC2=C(C(=C(C=C12)Cl)(O))C(NH+)(C)C
CCCCc1cc(=O)oc2c1cc(Cl)c(c2C(NH+)(C)C)(O)
InChI=1SC16H20ClNO3c145610714(19)211611(10)813(17)15(20)12(16)918(2)3h7820H469H213H3
MFCD04032084
ZINC000020332014
ZINC20332014
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