Vitas-M small molecule compound

dimethyl 2-{[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino}benzene-1,4-dicarboxylate

Catalog ID
STK417528
SMILES COC(=O)c1ccc(cc1NC(=O)/C=C/c1ccc(c(c1)OC)OC)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 C21H21NO7 MW 399.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO7/c1-26-17-9-5-13(11-18(17)27-2)6-10-19(23)22-16-12-14(20(24)28-3)7-8-15(16)21(25)29-4/h5-12H,1-4H3,(H,22,23)/b10-6+
InChIKey
QOZHIJMMZXHKHZ-UXBLZVDNSA-N
Synonyms

(E)DIMETHYL2(3(34DIMETHOXYPHENYL)ACRYLAMIDO)TEREPHTHALATE
COC(=O)c1ccc(cc1NC(=O)C=Cc1ccc(c(c1)OC)OC)C(=O)OC
COC1=C(C=C(C=C1)C=CC(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC)OC
dimethyl2(((2E)3(34dimethoxyphenyl)prop2enoyl)amino)benzene14dicarboxylate
DIMETHYL2(((E)3(34DIMETHOXYPHENYL)PROP2ENOYL)AMINO)BENZENE14DICARBOXYLATE
InChI=1SC21H21NO7c126179513(1118(17)272)61019(23)22161214(20(24)283)7815(16)21(25)294h512H14H3(H2223)b106+
METHYL3((2E)3(34DIMETHOXYPHENYL)PROP2ENOYLAMINO)4(METHOXYCARBONYL)BENZOATE
MFCD02081570
ZINC000001114972
ZINC01114972
ZINC1114972

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Available files

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