Vitas-M small molecule compound
2-cyclohexyl-5-[(3-nitrophenyl)carbonyl]-1H-isoindole-1,3(2H)-dione
Catalog ID
STK056011
SMILES O=C1c2cc(ccc2C(=O)N1C1CCCCC1)C(=O)c1cccc(c1)[N+](=O)[O-]
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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 C21H18N2O5 MW 378.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O5/c24-19(13-5-4-8-16(11-13)23(27)28)14-9-10-17-18(12-14)21(26)22(20(17)25)15-6-2-1-3-7-15/h4-5,8-12,15H,1-3,6-7H2InChIKey
KCRABKSEFJKVQL-UHFFFAOYSA-NSynonyms
2CYCLOHEXYL5((3NITROPHENYL)CARBONYL)1HISOINDOLE13(2H)DIONE
2CYCLOHEXYL5(3NITROBENZOYL)1HISOINDOLE13(2H)DIONE
2CYCLOHEXYL5(3NITROBENZOYL)ISOINDOLE13DIONE
C1CCC(CC1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC21H18N2O5c2419(1354816(1113)23(27)28)149101718(1214)21(26)22(20(17)25)156213715h4581215H1367H2
MFCD02032334
O=C1c2cc(ccc2C(=O)N1C1CCCCC1)C(=O)c1cccc(c1)(N+)(=O)(O)
STK056011
ZINC000001216151
ZINC01216151
ZINC1216151
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