Vitas-M small molecule compound
1-butyl-3-hydroxy-3-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK214735
SMILES CCCCN1c2ccccc2C(C1=O)(O)CC(=O)c1ccc(c(c1)[N+](=O)[O-])OC
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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 C21H22N2O6 MW 398.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O6/c1-3-4-11-22-16-8-6-5-7-15(16)21(26,20(22)25)13-18(24)14-9-10-19(29-2)17(12-14)23(27)28/h5-10,12,26H,3-4,11,13H2,1-2H3InChIKey
QHTHMTLKRLPPQE-UHFFFAOYSA-NSynonyms
689740-96-31BUTYL3HYDROXY3(2(4METHOXY3NITROPHENYL)2OXOETHYL)13DIHYDRO2HINDOL2ONE
1BUTYL3HYDROXY3(2(4METHOXY3NITROPHENYL)2OXOETHYL)INDOL2ONE
1BUTYL3HYDROXY3(2(4METHOXY3NITROPHENYL)2OXOETHYL)INDOLIN2ONE
689740963
CCCCN1C2=CC=CC=C2C(C1=O)(CC(=O)C3=CC(=C(C=C3)OC)(N+)(=O)(O))O
CCCCN1c2ccccc2C(C1=O)(O)CC(=O)c1ccc(c(c1)(N+)(=O)(O))OC
InChI=1SC21H22N2O6c134112216865715(16)21(2620(22)25)1318(24)1491019(292)17(1214)23(27)28h5101226H341113H212H3
MFCD03837256
ZINC000004554900
ZINC000004554901
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