Vitas-M small molecule compound

diethyl (6E)-4-hydroxy-4-methyl-6-[2-(4-nitrophenyl)hydrazinylidene]-2-phenylcyclohexane-1,3-dicarboxylate

Catalog ID
STK373518
SMILES CCOC(=O)C1/C(=N/Nc2ccc(cc2)[N+](=O)[O-])/CC(C(C1c1ccccc1)C(=O)OCC)(C)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 C25H29N3O7 MW 483.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O7/c1-4-34-23(29)21-19(27-26-17-11-13-18(14-12-17)28(32)33)15-25(3,31)22(24(30)35-5-2)20(21)16-9-7-6-8-10-16/h6-14,20-22,26,31H,4-5,15H2,1-3H3/b27-19+
InChIKey
APCTVGNZYXWDIB-ZXVVBBHZSA-N
Synonyms

CCOC(=O)C1C(=NNc2ccc(cc2)(N+)(=O)(O))CC(C(C1c1ccccc1)C(=O)OCC)(C)O
CCOC(=O)C1C(C(C(CC1=NNC2=CC=C(C=C2)(N+)(=O)(O))(C)O)C(=O)OCC)C3=CC=CC=C3
DIETHYL(6E)4HYDROXY4METHYL6((4NITROPHENYL)HYDRAZINYLIDENE)2PHENYLCYCLOHEXANE13DICARBOXYLATE
diethyl(6E)4hydroxy4methyl6(2(4nitrophenyl)hydrazinylidene)2phenylcyclohexane13dicarboxylate
InChI=1SC25H29N3O7c143423(29)2119(272617111318(141217)28(32)33)1525(331)22(24(30)3552)20(21)1697681016h61420222631H4515H213H3b2719+
MFCD00718255
ZINC000015938278
ZINC000036043165

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.