Vitas-M small molecule compound
2-{[4-(1,3-benzodioxol-5-yloxy)phenyl]carbamoyl}cyclohexanecarboxylic acid
Catalog ID
STK665233
SMILES O=C(C1CCCCC1C(=O)O)Nc1ccc(cc1)Oc1ccc2c(c1)OCO2
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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 C21H21NO6 MW 383.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO6/c23-20(16-3-1-2-4-17(16)21(24)25)22-13-5-7-14(8-6-13)28-15-9-10-18-19(11-15)27-12-26-18/h5-11,16-17H,1-4,12H2,(H,22,23)(H,24,25)InChIKey
PTZGWQRPRYQGKN-UHFFFAOYSA-NSynonyms
2((4(13BENZODIOXOL5YLOXY)PHENYL)CARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
2((4(13benzodioxol5yloxy)phenyl)carbamoyl)cyclohexanecarboxylicacid
C1CCC(C(C1)C(=O)NC2=CC=C(C=C2)OC3=CC4=C(C=C3)OCO4)C(=O)O
InChI=1SC21H21NO6c2320(16312417(16)21(24)25)22135714(8613)28159101819(1115)27122618h5111617H1412H2(H2223)(H2425)
MFCD08142396
ZINC000006668306
ZINC000006668309
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