4-Chloro-3-[2-(1-benzyl-3,5-dioxo-2-phenyl-1,2,4-triazolidin-4-yl)-4,4-dimethyl-3-oxovaleryamino]benzoic Acid 1-(Dodecyloxycarbonyl)pentyl Ester

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  • 96514-07-7
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Catalog Number
ACM96514077
Product Name
4-Chloro-3-[2-(1-benzyl-3,5-dioxo-2-phenyl-1,2,4-triazolidin-4-yl)-4,4-dimethyl-3-oxovaleryamino]benzoic Acid 1-(Dodecyloxycarbonyl)pentyl Ester
Structure
Structure
CAS
96514-07-7
Category
Heterocyclic Organic Compound
Synonyms
1,2,4-Triazolidine, benzoic acid deriv.;
IUPAC Name
(1-dodecoxy-1-oxohexan-2-yl)3-[[2-(1-benzyl-3,5-dioxo-2-phenyl-1,2,4-triazolidin-4-yl)-4,4-dimethyl-3-oxopentanoyl]amino]-4-chlorobenzoate
Molecular Weight
845.46224;g/mol
Molecular Formula
C47H61ClN4O8
Canonical SMILES
CCCCCCCCCCCCOC(=O)C(CCCC)OC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C(C)(C)C)N2C(=O)N(N(C2=O)C3=CC=CC=C3)CC4=CC=CC=C4
InChI Key
LEBVFPJIXSBUMZ-UHFFFAOYSA-N
Density
1.194±0.06 g/cm³ (20 °C, 760 mmHg)
Exact Mass
844.41800
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