Vitas-M small molecule compound

6-{[2,5-bis(methoxycarbonyl)phenyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid

Catalog ID
STK430132
SMILES COC(=O)c1ccc(cc1NC(=O)C1CC=CCC1C(=O)O)C(=O)OC

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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 C18H19NO7 MW 361.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO7/c1-25-17(23)10-7-8-13(18(24)26-2)14(9-10)19-15(20)11-5-3-4-6-12(11)16(21)22/h3-4,7-9,11-12H,5-6H2,1-2H3,(H,19,20)(H,21,22)
InChIKey
MDSYQNATYFLSAC-UHFFFAOYSA-N
Synonyms
352701-13-4
(1R6R)6((25BIS(METHOXYCARBONYL)PHENYL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
352701134
6((25bis(methoxycarbonyl)phenyl)carbamoyl)cyclohex3ene1carboxylicacid
COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2CC=CCC2C(=O)O
InChI=1SC18H19NO7c12517(23)107813(18(24)262)14(910)1915(20)11534612(11)16(21)22h34791112H56H212H3(H1920)(H2122)
MFCD01648011
ZINC000004904910
ZINC000004904919

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Available files

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