Vitas-M small molecule compound
1,1'-[1-benzyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-diyl]dioctan-1-one
Catalog ID
STL322187
SMILES CCCCCCCC(=O)C1=CN(Cc2ccccc2)C=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CCCCCCC
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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 C34H44N2O4 MW 544.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H44N2O4/c1-3-5-7-9-14-21-32(37)30-25-35(24-27-17-12-11-13-18-27)26-31(33(38)22-15-10-8-6-4-2)34(30)28-19-16-20-29(23-28)36(39)40/h11-13,16-20,23,25-26,34H,3-10,14-15,21-22,24H2,1-2H3InChIKey
XNLIAINDTXZMRU-UHFFFAOYSA-NSynonyms
304876-11-71(1BENZYL4(3NITROPHENYL)5OCTANOYL4HPYRIDIN3YL)OCTAN1ONE
11(1benzyl4(3nitrophenyl)14dihydropyridine35diyl)bis(octan1one)
11(1benzyl4(3nitrophenyl)14dihydropyridine35diyl)dioctan1one
304876117
CCCCCCCC(=O)C1=CN(C=C(C1C2=CC(=CC=C2)(N+)(=O)(O))C(=O)CCCCCCC)CC3=CC=CC=C3
CCCCCCCC(=O)C1=CN(Cc2ccccc2)C=C(C1c1cccc(c1)(N+)(=O)(O))C(=O)CCCCCCC
InChI=1SC34H44N2O4c13579142132(37)302535(2427171211131827)2631(33(38)2215108642)34(30)2819162029(2328)36(39)40h1113162023252634H3101415212224H212H3
MFCD01553281
ZINC000097949468
ZINC97949468
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