[propyl-bis[2-(trifluoromethyl)phenyl]azaniumyl]methanoate

Systemtic Name: [propyl-bis[2-(trifluoromethyl)phenyl]azaniumyl]methanoate Openeye Name: [propyl-bis[2-(trifluoromethyl)phenyl]ammonio]formate CAS Name: [propyl-bis[2-(trifluoromethyl)phenyl]ammonio]formate IUPAC Name: [propyl-bis[2-(trifluoromethyl)phenyl]azaniumyl]formate Traditional Name: [propyl-bis[2-(trifluoromethyl)phenyl]ammonio]formate Formula: C18H15F6NO2 MolecularWeight: 391.307619

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C1=CC=CC=C1C(F)(F)F)(C2=CC=CC=C2C(F)(F)F)C(=O)[O-]

Isomeric SMILES

CCC[N+](C1=CC=CC=C1C(F)(F)F)(C2=CC=CC=C2C(F)(F)F)C(=O)[O-]

InChI

InChI=1S/C18H15F6NO2/c1-2-11-25(16(26)27,14-9-5-3-7-12(14)17(19,20)21)15-10-6-4-8-13(15)18(22,23)24/h3-10H,2,11H2,1H3