Vitas-M small molecule compound
3-(4-chlorophenyl)-2-oxo-8-(pyrrolidinium-1-ylmethyl)-2H-chromen-7-olate
Catalog ID
STK622166
SMILES Clc1ccc(cc1)c1cc2ccc(c(c2oc1=O)C[NH+]1CCCC1)[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 C20H18ClNO3 MW 355.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClNO3/c21-15-6-3-13(4-7-15)16-11-14-5-8-18(23)17(19(14)25-20(16)24)12-22-9-1-2-10-22/h3-8,11,23H,1-2,9-10,12H2InChIKey
JECMGAOXZZCIEU-UHFFFAOYSA-NSynonyms
853749-42-53(4chlorophenyl)2oxo8(pyrrolidin1ium1ylmethyl)chromen7olate
3(4chlorophenyl)2oxo8(pyrrolidinium1ylmethyl)2Hchromen7olate
3(4CHLOROPHENYL)7HYDROXY8(PYRROLIDIN1YLMETHYL)CHROMEN2ONE
3(4CHLOROPHENYL)7HYDROXY8(PYRROLIDINYLMETHYL)CHROMEN2ONE
C1CC(NH+)(C1)CC2=C(C=CC3=C2OC(=O)C(=C3)C4=CC=C(C=C4)Cl)(O)
Clc1ccc(cc1)c1cc2ccc(c(c2oc1=O)C(NH+)1CCCC1)(O)
InChI=1SC20H18ClNO3c21156313(4715)1611145818(23)17(19(14)2520(16)24)12229121022h381123H1291012H2
MFCD06745728
ZINC000001237116
ZINC1237116
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