Vitas-M small molecule compound
3-methylphenyl 3-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzoate
Catalog ID
STK359348
SMILES Cc1cccc(c1)OC(=O)c1cccc(c1)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 C25H21NO4 MW 399.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO4/c1-13-4-2-7-16(10-13)30-25(29)14-5-3-6-15(11-14)26-23(27)21-17-8-9-18(20-12-19(17)20)22(21)24(26)28/h2-11,17-22H,12H2,1H3InChIKey
OBRQVRYNQRWLIZ-UHFFFAOYSA-NSynonyms
3methylphenyl3(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)benzoate
CC1=CC(=CC=C1)OC(=O)C2=CC(=CC=C2)N3C(=O)C4C5C=CC(C4C3=O)C6C5C6
InChI=1SC25H21NO4c11342716(1013)3025(29)1453615(1114)2623(27)21178918(201219(17)20)22(21)24(26)28h2111722H12H21H3
MFCD02314636
ZINC000239377539
ZINC000239377542
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