2-(aminomethyl)-5-[2,3-bis(trifluoromethyloxy)phenyl]-4-methyl-pentanoic acid

Systemtic Name: 2-(aminomethyl)-5-[2,3-bis(trifluoromethyloxy)phenyl]-4-methyl-pentanoic acid Openeye Name: 2-(aminomethyl)-5-[2,3-bis(trifluoromethoxy)phenyl]-4-methyl-pentanoic acid CAS Name: 2-(aminomethyl)-5-[2,3-bis(trifluoromethoxy)phenyl]-4-methylpentanoic acid IUPAC Name: 2-(aminomethyl)-5-[2,3-bis(trifluoromethoxy)phenyl]-4-methylpentanoic acid Traditional Name: 2-(aminomethyl)-5-[2,3-bis(trifluoromethoxy)phenyl]-4-methyl-valeric acid Formula: C15H17F6NO4 MolecularWeight: 389.290199

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(C(=CC=C1)OC(F)(F)F)OC(F)(F)F)CC(CN)C(=O)O

Isomeric SMILES

CC(CC1=C(C(=CC=C1)OC(F)(F)F)OC(F)(F)F)CC(CN)C(=O)O

InChI

InChI=1S/C15H17F6NO4/c1-8(6-10(7-22)13(23)24)5-9-3-2-4-11(25-14(16,17)18)12(9)26-15(19,20)21/h2-4,8,10H,5-7,22H2,1H3,(H,23,24)