Vitas-M small molecule compound
2-(5-acetyl-2-methoxyphenyl)-8-(diphenylmethylidene)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STK728364
SMILES COc1ccc(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 C31H25NO4 MW 475.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25NO4/c1-18(33)21-13-16-25(36-2)24(17-21)32-30(34)28-22-14-15-23(29(28)31(32)35)27(22)26(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-17,22-23,28-29H,1-2H3InChIKey
JEVRMEYXWUTABV-UHFFFAOYSA-NSynonyms
2(5acetyl2methoxyphenyl)8(diphenylmethylidene)3a477atetrahydro1H47methanoisoindole13(2H)dione
CC(=O)C1=CC(=C(C=C1)OC)N2C(=O)C3C4C=CC(C3C2=O)C4=C(C5=CC=CC=C5)C6=CC=CC=C6
COc1ccc(cc1N1C(=O)C2C(C1=O)C1C(=C(c3ccccc3)c3ccccc3)C2C=C1)C(=O)C
InChI=1SC31H25NO4c118(33)21131625(362)24(1721)3230(34)2822141523(29(28)31(32)35)27(22)26(1995361019)20117481220h31722232829H12H3
MFCD01802371
ZINC000101360512
ZINC000101360516
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