Vitas-M small molecule compound

N,N'-[(3,6-dichloro-9-oxo-9H-fluorene-2,7-diyl)bis(oxyethane-2,1-diyl)]bis(2-ethoxy-N,N-diethyl-2-oxoethanaminium)

Catalog ID
STK726934
SMILES CCOC(=O)C[N+](CCOc1cc2c(cc1Cl)c1c(C2=O)cc(c(c1)Cl)OCC[N+](CC(=O)OCC)(CC)CC)(CC)CC

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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 C33H46Cl2N2O7 MW 653.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H46Cl2N2O7/c1-7-36(8-2,21-31(38)41-11-5)13-15-43-29-19-25-23(17-27(29)34)24-18-28(35)30(20-26(24)33(25)40)44-16-14-37(9-3,10-4)22-32(39)42-12-6/h17-20H,7-16,21-22H2,1-6H3/q+2
InChIKey
NONXKMBHHPXEPZ-UHFFFAOYSA-N
Synonyms

2(36DICHLORO7(2((2ETHOXY2OXOETHYL)DIETHYLAZANIUMYL)ETHOXY)9OXOFLUOREN2YL)OXYETHYL(2ETHOXY2OXOETHYL)DIETHYLAZANIUM
CC(N+)(CC)(CCOC1=C(C=C2C(=C1)C(=O)C3=CC(=C(C=C32)Cl)OCC(N+)(CC)(CC)CC(=O)OCC)Cl)CC(=O)OCC
CCOC(=O)C(N+)(CCOc1cc2c(cc1Cl)c1c(C2=O)cc(c(c1)Cl)OCC(N+)(CC(=O)OCC)(CC)CC)(CC)CC
CCOC(=O)C(N+)(CCOc1cc2c(cc1Cl)c1c(C2=O)cc(c(c1)Cl)OCC(N+)(CC(=O)OCC)(CC)CC)(CC)CC(I)(I)
InChI=1SC33H46Cl2N2O7c1736(822131(38)41115)13154329192523(1727(29)34)241828(35)30(2026(24)33(25)40)44161437(93104)2232(39)42126h1720H7162122H216H3q+2
MFCD00985318
NN(((36dichloro9oxo9Hfluorene27diyl)bis(oxy))bis(ethane21diyl))bis(2ethoxyNNdiethyl2oxoethanaminium)iodide
NN((36dichloro9oxo9Hfluorene27diyl)bis(oxyethane21diyl))bis(2ethoxyNNdiethyl2oxoethanaminium)
ZINC000008453669
ZINC08453669
ZINC8453669

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Available files

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