Vitas-M small molecule compound
methyl 4-[8-(diphenylmethylidene)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]benzoate
Catalog ID
STK728365
SMILES COC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1/C(=C(\c3ccccc3)/c3ccccc3)/C2C=C1
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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 C30H23NO4 MW 461.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23NO4/c1-35-30(34)20-12-14-21(15-13-20)31-28(32)26-22-16-17-23(27(26)29(31)33)25(22)24(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-17,22-23,26-27H,1H3InChIKey
GMSGBLDWKSGRKP-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=C(C=C1)N2C(=O)C3C4C=CC(C3C2=O)C4=C(C5=CC=CC=C5)C6=CC=CC=C6
COC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1C(=C(c3ccccc3)c3ccccc3)C2C=C1
InChI=1SC30H23NO4c13530(34)20121421(151320)3128(32)2622161723(27(26)29(31)33)25(22)24(188425918)19106371119h21722232627H1H3
methyl4(8(diphenylmethylidene)13dioxo133a477ahexahydro2H47methanoisoindol2yl)benzoate
MFCD01571995
ZINC000101360552
ZINC000101360558
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