Vitas-M small molecule compound

4-({4-[3-(methoxycarbonyl)-2-methyl-5-oxo-4,5-dihydro-1H-indeno[1,2-b]pyridin-4-yl]phenoxy}methyl)benzoic acid

Catalog ID
STL378770
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OCc1ccc(cc1)C(=O)O)C(=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 C29H23NO6 MW 481.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23NO6/c1-16-23(29(34)35-2)24(25-26(30-16)21-5-3-4-6-22(21)27(25)31)18-11-13-20(14-12-18)36-15-17-7-9-19(10-8-17)28(32)33/h3-14,24,30H,15H2,1-2H3,(H,32,33)
InChIKey
ADAXYTWPNZLNMB-UHFFFAOYSA-N
Synonyms

4((4(3(METHOXYCARBONYL)2METHYL5OXO14DIHYDROINDENO(32B)PYRIDIN4YL)PHENOXY)METHYL)BENZOICACID
4((4(3(methoxycarbonyl)2methyl5oxo45dihydro1Hindeno(12b)pyridin4yl)phenoxy)methyl)benzoicacid
4((4(3METHOXYCARBONYL2METHYL5OXO14DIHYDROINDENO(12B)PYRIDIN4YL)PHENOXY)METHYL)BENZOICACID
CC1=C(C(C2=C(N1)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)OCC5=CC=C(C=C5)C(=O)O)C(=O)OC
InChI=1SC29H23NO6c11623(29(34)352)24(2526(3016)21534622(21)27(25)31)18111320(141218)3615177919(10817)28(32)33h3142430H15H212H3(H3233)
MFCD02228830
ZINC000000797884
ZINC000000797885

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Available files

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