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Structure

Potassium ionophore iii

CAS
99348-39-7
Catalog Number
ACM99348397
Category
Other Products
Molecular Weight
967.06
Molecular Formula
C46H70N4O18

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Specification

Synonyms
Potassium ionophore III, BME 44, AC1NQ0TF, 60397_FLUKA, 2-Dodecyl-2-methyl-1,3-propanediyl bis[N-[5-nitro(benzo-15-crown-5)-4-yl]carbamate, [2-methyl-2-[(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamoyloxymethyl]tetradecyl] N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate, 2-Dodecyl-2-methyl-1,3-propanediyl bis[N-[5 inverted exclamation marka-nitro(benzo-15-crown-5)-4 inverted exclamation marka-yl]carbamate], 99348-39-7
IUPAC Name
[2-methyl-2-[(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamoyloxymethyl]tetradecyl] N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate
Canonical SMILES
CCCCCCCCCCCCC(C)(COC(=O)NC1=CC2=C(C=C1[N+](=O)[O-])OCCOCCOCCOCCO2)COC(=O)NC3=CC4=C(C=C3[N+](=O)[O-])OCCOCCOCCOCCO4
InChI Key
ATWXVVNLVXXTQN-UHFFFAOYSA-N
Exact Mass
966.46900
H-Bond Acceptor
18
H-Bond Donor
2
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