Vitas-M small molecule compound

(2E)-1-(1,3-benzodioxol-5-yl)-3-[(3-chloro-4-methylphenyl)amino]prop-2-en-1-one

Catalog ID
STK902307
SMILES O=C(c1ccc2c(c1)OCO2)/C=C/Nc1ccc(c(c1)Cl)C

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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/c1-11-2-4-13(9-14(11)18)19-7-6-15(20)12-3-5-16-17(8-12)22-10-21-16/h2-9,19H,10H2,1H3/b7-6+
InChIKey
ZHXDGMXUHLLXOH-VOTSOKGWSA-N
Synonyms

(2E)1(13benzodioxol5yl)3((3chloro4methylphenyl)amino)prop2en1one
(E)1(13benzodioxol5yl)3(3chloro4methylanilino)prop2en1one
CC1=C(C=C(C=C1)NC=CC(=O)C2=CC3=C(C=C2)OCO3)Cl
InChI=1SC17H14ClNO3c1112413(914(11)18)197615(20)12351617(812)22102116h2919H10H21H3b76+
MFCD18174833
O=C(c1ccc2c(c1)OCO2)C=CNc1ccc(c(c1)Cl)C
ZINC000044842777
ZINC44842777

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Available files

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