Vitas-M small molecule compound
N-{[1-(3,4-dimethoxyphenyl)cyclohexyl]methyl}-2-nitrobenzamide
Catalog ID
STL335263
SMILES COc1cc(ccc1OC)C1(CCCCC1)CNC(=O)c1ccccc1[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 C22H26N2O5 MW 398.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O5/c1-28-19-11-10-16(14-20(19)29-2)22(12-6-3-7-13-22)15-23-21(25)17-8-4-5-9-18(17)24(26)27/h4-5,8-11,14H,3,6-7,12-13,15H2,1-2H3,(H,23,25)InChIKey
XXULNEHSMPPJAT-UHFFFAOYSA-NSynonyms
356781-94-7356781947
COC1=C(C=C(C=C1)C2(CCCCC2)CNC(=O)C3=CC=CC=C3(N+)(=O)(O))OC
COc1cc(ccc1OC)C1(CCCCC1)CNC(=O)c1ccccc1(N+)(=O)(O)
InChI=1SC22H26N2O5c12819111016(1420(19)292)22(126371322)152321(25)17845918(17)24(26)27h4581114H367121315H212H3(H2325)
MFCD01417778
N((1(34dimethoxyphenyl)cyclohexyl)methyl)2nitrobenzamide
ZINC000000657679
ZINC00657679
ZINC657679
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