Vitas-M small molecule compound
3-(4-bromophenoxy)-4-oxo-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate
Catalog ID
STL326381
SMILES O=C(Oc1ccc2c(c1)occ(c2=O)Oc1ccc(cc1)Br)CCNC(=O)OCc1ccccc1
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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 C26H20BrNO7 MW 538.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20BrNO7/c27-18-6-8-19(9-7-18)34-23-16-32-22-14-20(10-11-21(22)25(23)30)35-24(29)12-13-28-26(31)33-15-17-4-2-1-3-5-17/h1-11,14,16H,12-13,15H2,(H,28,31)InChIKey
IAVCWPCMUGVRQS-UHFFFAOYSA-NSynonyms
372153-10-1(3(4BROMOPHENOXY)4OXOCHROMEN7YL)3(PHENYLMETHOXYCARBONYLAMINO)PROPANOATE
3(4bromophenoxy)4oxo4Hchromen7yl3(((benzyloxy)carbonyl)amino)propanoate
3(4bromophenoxy)4oxo4Hchromen7ylN((benzyloxy)carbonyl)betaalaninate
372153101
C1=CC=C(C=C1)COC(=O)NCCC(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC=C(C=C4)Br
InChI=1SC26H20BrNO7c27186819(9718)34231632221420(101121(22)25(23)30)3524(29)12132826(31)3315174213517h1111416H121315H2(H2831)
MFCD00729702
ZINC000002274065
ZINC2274065
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