2-(aminomethyl)-4-[2,4-bis(trifluoromethyl)phenyl]hexanoic acid

Systemtic Name: 2-(aminomethyl)-4-[2,4-bis(trifluoromethyl)phenyl]hexanoic acid Openeye Name: 2-(aminomethyl)-4-[2,4-bis(trifluoromethyl)phenyl]hexanoic acid CAS Name: 2-(aminomethyl)-4-[2,4-bis(trifluoromethyl)phenyl]hexanoic acid IUPAC Name: 2-(aminomethyl)-4-[2,4-bis(trifluoromethyl)phenyl]hexanoic acid Traditional Name: 2-(aminomethyl)-4-[2,4-bis(trifluoromethyl)phenyl]hexanoic acid Formula: C15H17F6NO2 MolecularWeight: 357.291399

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(CN)C(=O)O)C1=C(C=C(C=C1)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCC(CC(CN)C(=O)O)C1=C(C=C(C=C1)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C15H17F6NO2/c1-2-8(5-9(7-22)13(23)24)11-4-3-10(14(16,17)18)6-12(11)15(19,20)21/h3-4,6,8-9H,2,5,7,22H2,1H3,(H,23,24)