3-azanyl-5-methyl-8-[2,3,4-tris(fluoranyl)phenyl]octanoic acid

Systemtic Name: 3-azanyl-5-methyl-8-[2,3,4-tris(fluoranyl)phenyl]octanoic acid Openeye Name: 3-amino-5-methyl-8-(2,3,4-trifluorophenyl)octanoic acid CAS Name: 3-amino-5-methyl-8-(2,3,4-trifluorophenyl)octanoic acid IUPAC Name: 3-amino-5-methyl-8-(2,3,4-trifluorophenyl)octanoic acid Traditional Name: 3-amino-5-methyl-8-(2,3,4-trifluorophenyl)caprylic acid Formula: C15H20F3NO2 MolecularWeight: 303.32001

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20F3NO2/c1-9(7-11(19)8-13(20)21)3-2-4-10-5-6-12(16)15(18)14(10)17/h5-6,9,11H,2-4,7-8,19H2,1H3,(H,20,21)