Vitas-M small molecule compound

4-chloro-2-[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]phenyl 3-methoxybenzoate

Catalog ID
STK542632
SMILES COc1cccc(c1)C(=O)Oc1ccc(cc1C(=O)/C=C/c1ccc(c(c1)OC)OC)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 C25H21ClO6 MW 452.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClO6/c1-29-19-6-4-5-17(14-19)25(28)32-22-12-9-18(26)15-20(22)21(27)10-7-16-8-11-23(30-2)24(13-16)31-3/h4-15H,1-3H3/b10-7+
InChIKey
OBECPXGKXPDFBK-JXMROGBWSA-N
Synonyms
433308-39-5
(4CHLORO2((E)3(34DIMETHOXYPHENYL)PROP2ENOYL)PHENYL)3METHOXYBENZOATE
(E)4chloro2(3(34dimethoxyphenyl)acryloyl)phenyl3methoxybenzoate
2((2E)3(34DIMETHOXYPHENYL)PROP2ENOYL)4CHLOROPHENYL3METHOXYBENZOATE
433308395
4chloro2((2E)3(34dimethoxyphenyl)prop2enoyl)phenyl3methoxybenzoate
COC1=C(C=C(C=C1)C=CC(=O)C2=C(C=CC(=C2)Cl)OC(=O)C3=CC(=CC=C3)OC)OC
COc1cccc(c1)C(=O)Oc1ccc(cc1C(=O)C=Cc1ccc(c(c1)OC)OC)Cl
InChI=1SC25H21ClO6c1291964517(1419)25(28)322212918(26)1520(22)21(27)1071681123(302)24(1316)313h415H13H3b107+
MFCD03290062
ZINC000009019496
ZINC09019496
ZINC9019496

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Available files

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