2-(aminomethyl)-4-[4-(trifluoromethyloxy)phenyl]pentanoic acid

Systemtic Name: 2-(aminomethyl)-4-[4-(trifluoromethyloxy)phenyl]pentanoic acid Openeye Name: 2-(aminomethyl)-4-[4-(trifluoromethoxy)phenyl]pentanoic acid CAS Name: 2-(aminomethyl)-4-[4-(trifluoromethoxy)phenyl]pentanoic acid IUPAC Name: 2-(aminomethyl)-4-[4-(trifluoromethoxy)phenyl]pentanoic acid Traditional Name: 2-(aminomethyl)-4-[4-(trifluoromethoxy)phenyl]valeric acid Formula: C13H16F3NO3 MolecularWeight: 291.26625

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16F3NO3/c1-8(6-10(7-17)12(18)19)9-2-4-11(5-3-9)20-13(14,15)16/h2-5,8,10H,6-7,17H2,1H3,(H,18,19)