Vitas-M small molecule compound
2-methylphenyl 4-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Catalog ID
STK253079
SMILES O=C1N(c2ccc(cc2)C(=O)Oc2ccccc2C)C(=O)C2C1C1CCC2C1
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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 C23H21NO4 MW 375.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO4/c1-13-4-2-3-5-18(13)28-23(27)14-8-10-17(11-9-14)24-21(25)19-15-6-7-16(12-15)20(19)22(24)26/h2-5,8-11,15-16,19-20H,6-7,12H2,1H3InChIKey
XZJGUDHTKFDDOX-UHFFFAOYSA-NSynonyms
2methylphenyl4(13dioxooctahydro2H47methanoisoindol2yl)benzoate
CC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)N3C(=O)C4C5CCC(C5)C4C3=O
InChI=1SC23H21NO4c113423518(13)2823(27)1481017(11914)2421(25)19156716(1215)20(19)22(24)26h2581115161920H6712H21H3
MFCD03165076
ZINC000100912645
ZINC000239248065
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