Vitas-M small molecule compound

methyl 4-{[(2Z)-2-chloro-3-phenylprop-2-enoyl]amino}benzoate

Catalog ID
STK037085
SMILES COC(=O)c1ccc(cc1)NC(=O)/C(=C/c1ccccc1)/Cl

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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 C17H14ClNO3 MW 315.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClNO3/c1-22-17(21)13-7-9-14(10-8-13)19-16(20)15(18)11-12-5-3-2-4-6-12/h2-11H,1H3,(H,19,20)/b15-11-
InChIKey
FDDFOLZATRUXAQ-PTNGSMBKSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=CC=C2)Cl
COC(=O)c1ccc(cc1)NC(=O)C(=Cc1ccccc1)Cl
InChI=1SC17H14ClNO3c12217(21)137914(10813)1916(20)15(18)11125324612h211H1H3(H1920)b1511
METHYL4(((2Z)2CHLORO3PHENYLPROP2ENOYL)AMINO)BENZOATE
METHYL4(((Z)2CHLORO3PHENYLPROP2ENOYL)AMINO)BENZOATE
METHYL4((2Z)2CHLORO3PHENYLPROP2ENOYLAMINO)BENZOATE
MFCD02655674
STK037085
ZINC000000456936
ZINC00456936
ZINC456936

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Available files

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