Vitas-M small molecule compound
N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-3,5-dimethyltricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Catalog ID
STL176485
SMILES Cc1cc(ccc1Cl)Oc1cc(cc(c1)[N+](=O)[O-])NC(=O)C12CC3CC(C2)(CC(C1)(C3)C)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 C26H29ClN2O4 MW 468.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29ClN2O4/c1-16-6-20(4-5-22(16)27)33-21-8-18(7-19(9-21)29(31)32)28-23(30)26-12-17-10-24(2,14-26)13-25(3,11-17)15-26/h4-9,17H,10-15H2,1-3H3,(H,28,30)InChIKey
PWPYZOLGNLEJTR-UHFFFAOYSA-NSynonyms
769930-46-3769930463
CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)(N+)(=O)(O))NC(=O)C34CC5CC(C3)(CC(C5)(C4)C)C)Cl
Cc1cc(ccc1Cl)Oc1cc(cc(c1)(N+)(=O)(O))NC(=O)C12CC3CC(C2)(CC(C1)(C3)C)C
InChI=1SC26H29ClN2O4c116620(4522(16)27)3321818(719(921)29(31)32)2823(30)2612171024(21426)1325(31117)1526h4917H1015H213H3(H2830)
N(3(4CHLORO3METHYLPHENOXY)5NITROPHENYL)35DIMETHYLADAMANTANE1CARBOXAMIDE
N(3(4chloro3methylphenoxy)5nitrophenyl)35dimethyltricyclo(3311~37~)decane1carboxamide
ZINC000002743770
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