Vitas-M small molecule compound
(4-{(E)-[(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)imino]methyl}phenoxy)acetic acid
Catalog ID
STK263876
SMILES OC(=O)COc1ccc(cc1)/C=N/N1C(=O)C2C(C1=O)C1C=CC2C2C1C2
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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 C20H18N2O5 MW 366.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5/c23-16(24)9-27-11-3-1-10(2-4-11)8-21-22-19(25)17-12-5-6-13(15-7-14(12)15)18(17)20(22)26/h1-6,8,12-15,17-18H,7,9H2,(H,23,24)/b21-8+InChIKey
HMOZAQDHNBHCEI-ODCIPOBUSA-NSynonyms
(4((E)((13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)IMINO)METHYL)PHENOXY)ACETICACID
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)N=CC5=CC=C(C=C5)OCC(=O)O
InChI=1SC20H18N2O5c2316(24)927113110(2411)8212219(25)17125613(15714(12)15)18(17)20(22)26h16812151718H79H2(H2324)b218+
MFCD03715744
OC(=O)COc1ccc(cc1)C=NN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
ZINC000245226661
ZINC000245226664
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