Vitas-M small molecule compound
1,1'-{6-hydroxy-6-methyl-4-[(4-methylphenyl)amino]-2-(3-nitrophenyl)cyclohex-3-ene-1,3-diyl}diethanone
Catalog ID
STK558055
SMILES Cc1ccc(cc1)NC1=C(C(=O)C)C(C(C(C1)(C)O)C(=O)C)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 C24H26N2O5 MW 422.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O5/c1-14-8-10-18(11-9-14)25-20-13-24(4,29)23(16(3)28)22(21(20)15(2)27)17-6-5-7-19(12-17)26(30)31/h5-12,22-23,25,29H,13H2,1-4H3InChIKey
WFNHNYCJEHMOFY-UHFFFAOYSA-NSynonyms
1008065-27-71(3ACETYL6HYDROXY6METHYL4(4METHYLANILINO)2(3NITROPHENYL)CYCLOHEX3EN1YL)ETHANONE
1008065277
11(3hydroxy3methyl3nitro5(ptolylamino)1234tetrahydro(11biphenyl)26diyl)diethanone
11(6hydroxy6methyl4((4methylphenyl)amino)2(3nitrophenyl)cyclohex3ene13diyl)diethanone
CC1=CC=C(C=C1)NC2=C(C(C(C(C2)(C)O)C(=O)C)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)C
Cc1ccc(cc1)NC1=C(C(=O)C)C(C(C(C1)(C)O)C(=O)C)c1cccc(c1)(N+)(=O)(O)
InChI=1SC24H26N2O5c11481018(11914)25201324(429)23(16(3)28)22(21(20)15(2)27)1765719(1217)26(30)31h51222232529H13H214H3
MFCD02160896
ZINC000005051276
ZINC000005051296
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