Vitas-M small molecule compound
2-chloro-3-hydroxy-4-(pyrrolidin-1-ylmethyl)-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
Catalog ID
STK716791
SMILES Oc1c(Cl)cc2c(c1CN1CCCC1)oc(=O)c1c2CCCC1
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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 C18H20ClNO3 MW 333.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClNO3/c19-15-9-13-11-5-1-2-6-12(11)18(22)23-17(13)14(16(15)21)10-20-7-3-4-8-20/h9,21H,1-8,10H2InChIKey
UKZNINYYYYNLBI-UHFFFAOYSA-NSynonyms
581785-46-82chloro3hydroxy4(pyrrolidin1ylmethyl)78910tetrahydro6Hbenzo(c)chromen6one
2chloro6oxo4(pyrrolidin1ium1ylmethyl)78910tetrahydrobenzo(c)chromen3olate
581785468
C1CCC2=C(C1)C3=CC(=C(C(=C3OC2=O)C(NH+)4CCCC4)(O))Cl
InChI=1SC18H20ClNO3c191591311512612(11)18(22)2317(13)14(16(15)21)1020734820h921H1810H2
MFCD02336904
ZINC000020132714
ZINC20132714
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