Vitas-M small molecule compound
6-{[4-(ethoxycarbonyl)phenyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK458555
SMILES CCOC(=O)c1ccc(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 C17H19NO5 MW 317.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO5/c1-2-23-17(22)11-7-9-12(10-8-11)18-15(19)13-5-3-4-6-14(13)16(20)21/h3-4,7-10,13-14H,2,5-6H2,1H3,(H,18,19)(H,20,21)InChIKey
XQCAPQCPJODDFO-UHFFFAOYSA-NSynonyms
6((4(ethoxycarbonyl)phenyl)carbamoyl)cyclohex3ene1carboxylicacid
6((4ETHOXYCARBONYLPHENYL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
6(N(4(ETHOXYCARBONYL)PHENYL)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC=CCC2C(=O)O
InChI=1SC17H19NO5c122317(22)117912(10811)1815(19)13534614(13)16(20)21h347101314H256H21H3(H1819)(H2021)
MFCD01062933
ZINC000005461641
ZINC000005461678
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