Vitas-M small molecule compound
4-({2-bromo-4-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]phenoxy}methyl)benzoic acid
Catalog ID
STK161037
SMILES Brc1cc(ccc1OCc1ccc(cc1)C(=O)O)/C=C/1\C(=O)c2c(C1=O)cccc2
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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 C24H15BrO5 MW 463.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H15BrO5/c25-20-12-15(11-19-22(26)17-3-1-2-4-18(17)23(19)27)7-10-21(20)30-13-14-5-8-16(9-6-14)24(28)29/h1-12H,13H2,(H,28,29)InChIKey
YLYQJSZCJOFYNL-UHFFFAOYSA-NSynonyms
4((2BROMO4((13DIOXO13DIHYDRO2HINDEN2YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
4((2BROMO4((13DIOXOINDEN2YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
Brc1cc(ccc1OCc1ccc(cc1)C(=O)O)C=C1C(=O)c2c(C1=O)cccc2
C1=CC=C2C(=C1)C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=C(C=C4)C(=O)O)Br)C2=O
InChI=1SC24H15BrO5c25201215(111922(26)17312418(17)23(19)27)71021(20)3013145816(9614)24(28)29h112H13H2(H2829)
MFCD04369946
ZINC000009323367
ZINC9323367
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