Vitas-M small molecule compound
8-cyclohexylidene-2-(3-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STL336758
SMILES O=C1N(c2cccc(c2)[N+](=O)[O-])C(=O)C2C1C1C=CC2C1=C1CCCCC1
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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 C21H20N2O4 MW 364.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O4/c24-20-18-15-9-10-16(17(15)12-5-2-1-3-6-12)19(18)21(25)22(20)13-7-4-8-14(11-13)23(26)27/h4,7-11,15-16,18-19H,1-3,5-6H2InChIKey
ARYQMOWMQUHBMY-UHFFFAOYSA-NSynonyms
1007932-81-1(3aR4R7S7aS)8cyclohexylidene2(3nitrophenyl)3a477atetrahydro1H47methanoisoindole13(2H)dione
1007932811
8cyclohexylidene2(3nitrophenyl)3a477atetrahydro1H47methanoisoindole13(2H)dione
C1CCC(=C2C3C=CC2C4C3C(=O)N(C4=O)C5=CC(=CC=C5)(N+)(=O)(O))CC1
InChI=1SC21H20N2O4c2420181591016(17(15)125213612)19(18)21(25)22(20)1374814(1113)23(26)27h471115161819H1356H2
MFCD01188358
O=C1N(c2cccc(c2)(N+)(=O)(O))C(=O)C2C1C1C=CC2C1=C1CCCCC1
ZINC000226939526
ZINC000239274800
Check stock
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