2-[[4-(4-fluorophenyl)phenyl]methyl]-2-(2-methylpropylcarbamoylamino)-4-oxidanyl-pentanedioic acid

Systemtic Name: 2-[[4-(4-fluorophenyl)phenyl]methyl]-2-(2-methylpropylcarbamoylamino)-4-oxidanyl-pentanedioic acid Openeye Name: 2-[[4-(4-fluorophenyl)phenyl]methyl]-4-hydroxy-2-(isobutylcarbamoylamino)pentanedioic acid CAS Name: 2-[[4-(4-fluorophenyl)phenyl]methyl]-4-hydroxy-2-[[(2-methylpropylamino)-oxomethyl]amino]pentanedioic acid IUPAC Name: 2-[[4-(4-fluorophenyl)phenyl]methyl]-4-hydroxy-2-(2-methylpropylcarbamoylamino)pentanedioic acid Traditional Name: 2-[4-(4-fluorophenyl)benzyl]-4-hydroxy-2-(isobutylcarbamoylamino)glutaric acid Formula: C23H27FN2O6 MolecularWeight: 446.468683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(CC1=CC=C(C=C1)C2=CC=C(C=C2)F)(CC(C(=O)O)O)C(=O)O

Isomeric SMILES

CC(C)CNC(=O)NC(CC1=CC=C(C=C1)C2=CC=C(C=C2)F)(CC(C(=O)O)O)C(=O)O

InChI

InChI=1S/C23H27FN2O6/c1-14(2)13-25-22(32)26-23(21(30)31,12-19(27)20(28)29)11-15-3-5-16(6-4-15)17-7-9-18(24)10-8-17/h3-10,14,19,27H,11-13H2,1-2H3,(H,28,29)(H,30,31)(H2,25,26,32)