2-(aminomethyl)-4-methyl-7-[3-(trifluoromethyl)phenyl]heptanoic acid

Systemtic Name: 2-(aminomethyl)-4-methyl-7-[3-(trifluoromethyl)phenyl]heptanoic acid Openeye Name: 2-(aminomethyl)-4-methyl-7-[3-(trifluoromethyl)phenyl]heptanoic acid CAS Name: 2-(aminomethyl)-4-methyl-7-[3-(trifluoromethyl)phenyl]heptanoic acid IUPAC Name: 2-(aminomethyl)-4-methyl-7-[3-(trifluoromethyl)phenyl]heptanoic acid Traditional Name: 2-(aminomethyl)-4-methyl-7-[3-(trifluoromethyl)phenyl]enanthic acid Formula: C16H22F3NO2 MolecularWeight: 317.34659

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC(=CC=C1)C(F)(F)F)CC(CN)C(=O)O

Isomeric SMILES

CC(CCCC1=CC(=CC=C1)C(F)(F)F)CC(CN)C(=O)O

InChI

InChI=1S/C16H22F3NO2/c1-11(8-13(10-20)15(21)22)4-2-5-12-6-3-7-14(9-12)16(17,18)19/h3,6-7,9,11,13H,2,4-5,8,10,20H2,1H3,(H,21,22)