Vitas-M small molecule compound
4-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)phenyl 3-methoxybenzoate
Catalog ID
STL338206
SMILES COc1cccc(c1)C(=O)Oc1ccc(cc1)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 C25H21NO5 MW 415.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO5/c1-30-16-4-2-3-13(11-16)25(29)31-15-7-5-14(6-8-15)26-23(27)21-17-9-10-18(20-12-19(17)20)22(21)24(26)28/h2-11,17-22H,12H2,1H3InChIKey
SLTBMMZTCUCZOM-UHFFFAOYSA-NSynonyms
489400-49-94(13dioxo33a44a55a66aoctahydro46ethenocyclopropa(f)isoindol2(1H)yl)phenyl3methoxybenzoate
4(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)phenyl3methoxybenzoate
489400499
COC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)N3C(=O)C4C5C=CC(C4C3=O)C6C5C6
InChI=1SC25H21NO5c1301642313(1116)25(29)31157514(6815)2623(27)211791018(201219(17)20)22(21)24(26)28h2111722H12H21H3
MFCD03070685
ZINC000245240768
ZINC000245240771
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