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

Systemtic Name: 2-[(4-fluorophenyl)methyl]-2-(2-methylpropylcarbamoylamino)-4-oxidanyl-pentanedioic acid Openeye Name: 2-[(4-fluorophenyl)methyl]-4-hydroxy-2-(isobutylcarbamoylamino)pentanedioic acid CAS Name: 2-[(4-fluorophenyl)methyl]-4-hydroxy-2-[[(2-methylpropylamino)-oxomethyl]amino]pentanedioic acid IUPAC Name: 2-[(4-fluorophenyl)methyl]-4-hydroxy-2-(2-methylpropylcarbamoylamino)pentanedioic acid Traditional Name: 2-(4-fluorobenzyl)-4-hydroxy-2-(isobutylcarbamoylamino)glutaric acid Formula: C17H23FN2O6 MolecularWeight: 370.372723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23FN2O6/c1-10(2)9-19-16(26)20-17(15(24)25,8-13(21)14(22)23)7-11-3-5-12(18)6-4-11/h3-6,10,13,21H,7-9H2,1-2H3,(H,22,23)(H,24,25)(H2,19,20,26)