2-[3-(4-fluorophenyl)propanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[3-(4-fluorophenyl)propanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[3-(4-fluorophenyl)propanoylamino]-3-methyl-butanoic acid CAS Name: 2-[[3-(4-fluorophenyl)-1-oxopropyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[3-(4-fluorophenyl)propanoylamino]-3-methylbutanoic acid Traditional Name: 2-[3-(4-fluorophenyl)propanoylamino]-3-methyl-butyric acid Formula: C14H18FNO3 MolecularWeight: 267.296023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CCC1=CC=C(C=C1)F

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)CCC1=CC=C(C=C1)F

InChI

InChI=1S/C14H18FNO3/c1-9(2)13(14(18)19)16-12(17)8-5-10-3-6-11(15)7-4-10/h3-4,6-7,9,13H,5,8H2,1-2H3,(H,16,17)(H,18,19)