3-[(2-azanyl-3-methyl-pentanoyl)amino]-4-fluoranyl-benzoic acid

Systemtic Name: 3-[(2-azanyl-3-methyl-pentanoyl)amino]-4-fluoranyl-benzoic acid Openeye Name: 3-[(2-amino-3-methyl-pentanoyl)amino]-4-fluoro-benzoic acid CAS Name: 3-[(2-amino-3-methyl-1-oxopentyl)amino]-4-fluorobenzoic acid IUPAC Name: 3-[(2-amino-3-methylpentanoyl)amino]-4-fluorobenzoic acid Traditional Name: 3-[(2-amino-3-methyl-pentanoyl)amino]-4-fluoro-benzoic acid Formula: C13H17FN2O3 MolecularWeight: 268.284083

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=C(C=CC(=C1)C(=O)O)F)N

Isomeric SMILES

CCC(C)C(C(=O)NC1=C(C=CC(=C1)C(=O)O)F)N

InChI

InChI=1S/C13H17FN2O3/c1-3-7(2)11(15)12(17)16-10-6-8(13(18)19)4-5-9(10)14/h4-7,11H,3,15H2,1-2H3,(H,16,17)(H,18,19)