Vitas-M small molecule compound

methyl 4-[(4-cyanophenyl)amino]-4-oxobutanoate

Catalog ID
STK044960
SMILES COC(=O)CCC(=O)Nc1ccc(cc1)C#N

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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 C12H12N2O3 MW 232.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O3/c1-17-12(16)7-6-11(15)14-10-4-2-9(8-13)3-5-10/h2-5H,6-7H2,1H3,(H,14,15)
InChIKey
YDYONKMINMVIMJ-UHFFFAOYSA-N
Synonyms
306325-34-8
306325348
COC(=O)CCC(=O)NC1=CC=C(C=C1)C#N
COC(=O)CCC(=O)Nc1ccc(cc1)C#N
InChI=1SC12H12N2O3c11712(16)7611(15)1410429(813)3510h25H67H21H3(H1415)
METHYL3(N(4CYANOPHENYL)CARBAMOYL)PROPANOATE
METHYL4((4CYANOPHENYL)AMINO)4OXOBUTANOATE
METHYL4(4CYANOANILINO)4OXOBUTANOATE
MFCD00566780
STK044960
ZINC000000125252
ZINC00125252
ZINC125252

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Available files

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