2-(aminomethyl)-4-methyl-7-[2-(trifluoromethyl)phenyl]heptanoic acid

Systemtic Name: 2-(aminomethyl)-4-methyl-7-[2-(trifluoromethyl)phenyl]heptanoic acid Openeye Name: 2-(aminomethyl)-4-methyl-7-[2-(trifluoromethyl)phenyl]heptanoic acid CAS Name: 2-(aminomethyl)-4-methyl-7-[2-(trifluoromethyl)phenyl]heptanoic acid IUPAC Name: 2-(aminomethyl)-4-methyl-7-[2-(trifluoromethyl)phenyl]heptanoic acid Traditional Name: 2-(aminomethyl)-4-methyl-7-[2-(trifluoromethyl)phenyl]enanthic acid Formula: C16H22F3NO2 MolecularWeight: 317.34659

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC=CC=C1C(F)(F)F)CC(CN)C(=O)O

Isomeric SMILES

CC(CCCC1=CC=CC=C1C(F)(F)F)CC(CN)C(=O)O

InChI

InChI=1S/C16H22F3NO2/c1-11(9-13(10-20)15(21)22)5-4-7-12-6-2-3-8-14(12)16(17,18)19/h2-3,6,8,11,13H,4-5,7,9-10,20H2,1H3,(H,21,22)