2-[(3-fluorophenyl)methyl-methyl-amino]-3-methyl-butanoic acid

Systemtic Name: 2-[(3-fluorophenyl)methyl-methyl-amino]-3-methyl-butanoic acid Openeye Name: 2-[(3-fluorophenyl)methyl-methyl-amino]-3-methyl-butanoic acid CAS Name: 2-[(3-fluorophenyl)methyl-methylamino]-3-methylbutanoic acid IUPAC Name: 2-[(3-fluorophenyl)methyl-methylamino]-3-methylbutanoic acid Traditional Name: 2-[(3-fluorobenzyl)-methyl-amino]-3-methyl-butyric acid Formula: C13H18FNO2 MolecularWeight: 239.285923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N(C)CC1=CC(=CC=C1)F

Isomeric SMILES

CC(C)C(C(=O)O)N(C)CC1=CC(=CC=C1)F

InChI

InChI=1S/C13H18FNO2/c1-9(2)12(13(16)17)15(3)8-10-5-4-6-11(14)7-10/h4-7,9,12H,8H2,1-3H3,(H,16,17)