5-azanyl-2-[(3-fluoranyl-4-methyl-phenyl)carbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[(3-fluoranyl-4-methyl-phenyl)carbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[(3-fluoro-4-methyl-benzoyl)amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[(3-fluoro-4-methylphenyl)-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[(3-fluoro-4-methylbenzoyl)amino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[(3-fluoro-4-methyl-benzoyl)amino]-5-keto-valeric acid Formula: C13H15FN2O4 MolecularWeight: 282.267603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(CCC(=O)N)C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(CCC(=O)N)C(=O)O)F

InChI

InChI=1S/C13H15FN2O4/c1-7-2-3-8(6-9(7)14)12(18)16-10(13(19)20)4-5-11(15)17/h2-3,6,10H,4-5H2,1H3,(H2,15,17)(H,16,18)(H,19,20)