Vitas-M small molecule compound

1-(2-{[(2,4-dichlorophenoxy)acetyl]amino}ethyl)-1-[2-(octyloxy)-2-oxoethyl]piperidinium

Catalog ID
STK012872
SMILES CCCCCCCCOC(=O)C[N+]1(CCCCC1)CCNC(=O)COc1ccc(cc1Cl)Cl

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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 C25H39Cl2N2O4 MW 502.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H38Cl2N2O4/c1-2-3-4-5-6-10-17-32-25(31)19-29(14-8-7-9-15-29)16-13-28-24(30)20-33-23-12-11-21(26)18-22(23)27/h11-12,18H,2-10,13-17,19-20H2,1H3/p+1
InChIKey
OEXFEKDHGIQJKS-UHFFFAOYSA-O
Synonyms

1(2(((24DICHLOROPHENOXY)ACETYL)AMINO)ETHYL)1(2(OCTYLOXY)2OXOETHYL)PIPERIDINIUM
CCCCCCCCOC(=O)C(N+)1(CCCCC1)CCNC(=O)COc1ccc(cc1Cl)Cl
CCCCCCCCOC(=O)C(N+)1(CCCCC1)CCNC(=O)COC2=C(C=C(C=C2)Cl)Cl
InChI=1SC25H38Cl2N2O4c12345610173225(31)1929(148791529)16132824(30)203323121121(26)1822(23)27h111218H21013171920H21H3p+1
MFCD09267141
OCTYL2(1(2((2(24DICHLOROPHENOXY)ACETYL)AMINO)ETHYL)PIPERIDIN1IUM1YL)ACETATE
STK012872
ZINC000068576545
ZINC68576545

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Available files

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