Vitas-M small molecule compound
2-(5-acetyl-2-ethoxyphenyl)-8-(diphenylmethylidene)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STK393446
SMILES CCOc1ccc(cc1N1C(=O)C2C(C1=O)C1/C(=C(/c3ccccc3)\c3ccccc3)/C2C=C1)C(=O)C
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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 C32H27NO4 MW 489.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H27NO4/c1-3-37-26-17-14-22(19(2)34)18-25(26)33-31(35)29-23-15-16-24(30(29)32(33)36)28(23)27(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-18,23-24,29-30H,3H2,1-2H3InChIKey
FVQWKJIQANKNAA-UHFFFAOYSA-NSynonyms
2(5acetyl2ethoxyphenyl)8(diphenylmethylidene)3a477atetrahydro1H47methanoisoindole13(2H)dione
CCOC1=C(C=C(C=C1)C(=O)C)N2C(=O)C3C4C=CC(C3C2=O)C4=C(C5=CC=CC=C5)C6=CC=CC=C6
CCOc1ccc(cc1N1C(=O)C2C(C1=O)C1C(=C(c3ccccc3)c3ccccc3)C2C=C1)C(=O)C
InChI=1SC32H27NO4c133726171422(19(2)34)1825(26)3331(35)2923151624(30(29)32(33)36)28(23)27(20106471120)21128591321h41823242930H3H212H3
MFCD01802377
ZINC000101391577
ZINC000101391582
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