Vitas-M small molecule compound

6-{[4-(4-cyanophenoxy)phenyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid

Catalog ID
STK252526
SMILES N#Cc1ccc(cc1)Oc1ccc(cc1)NC(=O)C1CC=CCC1C(=O)O

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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 C21H18N2O4 MW 362.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O4/c22-13-14-5-9-16(10-6-14)27-17-11-7-15(8-12-17)23-20(24)18-3-1-2-4-19(18)21(25)26/h1-2,5-12,18-19H,3-4H2,(H,23,24)(H,25,26)
InChIKey
ZOXFXPZJXICCBF-UHFFFAOYSA-N
Synonyms

6((4(4CYANOPHENOXY)ANILINO)CARBONYL)3CYCLOHEXENE1CARBOXYLICACID
6((4(4CYANOPHENOXY)PHENYL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
6(4(4CYANOPHENOXY)PHENYLCARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
6(N(4(4CYANOPHENOXY)PHENYL)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
C1C=CCC(C1C(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)C#N)C(=O)O
InChI=1SC21H18N2O4c2213145916(10614)271711715(81217)2320(24)18312419(18)21(25)26h125121819H34H2(H2324)(H2526)
MFCD01576722
ZINC000000849545
ZINC000000849548

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Available files

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