(2S)-5-[(3-fluoranyl-4-phenyl-phenyl)carbonylamino]-5-oxidanylidene-2-[(phenylmethyl)amino]pentanoic acid

Systemtic Name: (2S)-5-[(3-fluoranyl-4-phenyl-phenyl)carbonylamino]-5-oxidanylidene-2-[(phenylmethyl)amino]pentanoic acid Openeye Name: (2S)-2-(benzylamino)-5-[(3-fluoro-4-phenyl-benzoyl)amino]-5-oxo-pentanoic acid CAS Name: (2S)-5-[[(3-fluoro-4-phenylphenyl)-oxomethyl]amino]-5-oxo-2-[(phenylmethyl)amino]pentanoic acid IUPAC Name: (2S)-2-(benzylamino)-5-[(3-fluoro-4-phenylbenzoyl)amino]-5-oxopentanoic acid Traditional Name: (2S)-2-(benzylamino)-5-[(3-fluoro-4-phenyl-benzoyl)amino]-5-keto-valeric acid Formula: C25H23FN2O4 MolecularWeight: 434.459523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(CCC(=O)NC(=O)C2=CC(=C(C=C2)C3=CC=CC=C3)F)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN[C@@H](CCC(=O)NC(=O)C2=CC(=C(C=C2)C3=CC=CC=C3)F)C(=O)O

InChI

InChI=1S/C25H23FN2O4/c26-21-15-19(11-12-20(21)18-9-5-2-6-10-18)24(30)28-23(29)14-13-22(25(31)32)27-16-17-7-3-1-4-8-17/h1-12,15,22,27H,13-14,16H2,(H,31,32)(H,28,29,30)/t22-/m0/s1