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4-[2-[2-(trifluoromethyl)pyrrolidin-1-yl]propanoylamino]adamantane-1-carboxylic acid

4-[2-[2-(trifluoromethyl)pyrrolidin-1-yl]propanoylamino]adamantane-1-carboxylic acid

Systemtic Name:4-[2-[2-(trifluoromethyl)pyrrolidin-1-yl]propanoylamino]adamantane-1-carboxylic acid
Openeye Name:4-[2-[2-(trifluoromethyl)pyrrolidin-1-yl]propanoylamino]adamantane-1-carboxylic acid
CAS Name:4-[[1-oxo-2-[2-(trifluoromethyl)-1-pyrrolidinyl]propyl]amino]-1-adamantanecarboxylic acid
IUPAC Name:4-[2-[2-(trifluoromethyl)pyrrolidin-1-yl]propanoylamino]adamantane-1-carboxylic acid
Traditional Name:4-[2-[2-(trifluoromethyl)pyrrolidino]propanoylamino]adamantane-1-carboxylic acid
Formula: C19H27F3N2O3
MolecularWeight: 388.42449
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1C2CC3CC1CC(C3)(C2)C(=O)O)N4CCCC4C(F)(F)F


Isomeric SMILES

CC(C(=O)NC1C2CC3CC1CC(C3)(C2)C(=O)O)N4CCCC4C(F)(F)F


InChI

InChI=1S/C19H27F3N2O3/c1-10(24-4-2-3-14(24)19(20,21)22)16(25)23-15-12-5-11-6-13(15)9-18(7-11,8-12)17(26)27/h10-15H,2-9H2,1H3,(H,23,25)(H,26,27)


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