Vitas-M small molecule compound

dimethyl 5-{[(2-phenylcyclopropyl)carbonyl]amino}benzene-1,3-dicarboxylate

Catalog ID
STK421894
SMILES COC(=O)c1cc(NC(=O)C2CC2c2ccccc2)cc(c1)C(=O)OC

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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 C20H19NO5 MW 353.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO5/c1-25-19(23)13-8-14(20(24)26-2)10-15(9-13)21-18(22)17-11-16(17)12-6-4-3-5-7-12/h3-10,16-17H,11H2,1-2H3,(H,21,22)
InChIKey
PGRZLCYCRAGPEL-UHFFFAOYSA-N
Synonyms
329042-89-9
329042899
COC(=O)C1=CC(=CC(=C1)NC(=O)C2CC2C3=CC=CC=C3)C(=O)OC
dimethyl5(((2phenylcyclopropyl)carbonyl)amino)benzene13dicarboxylate
DIMETHYL5(((2PHENYLCYCLOPROPYL)CARBONYL)AMINO)ISOPHTHALATE
DIMETHYL5((2PHENYLCYCLOPROPANECARBONYL)AMINO)BENZENE13DICARBOXYLATE
InChI=1SC20H19NO5c12519(23)13814(20(24)262)1015(913)2118(22)171116(17)126435712h3101617H11H212H3(H2122)
MFCD00861295
ZINC000000688723
ZINC000004646545

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Available files

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