(2S)-5-azanyl-2-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]-5-oxidanylidene-pentanoate

Systemtic Name: (2S)-5-azanyl-2-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]-5-oxidanylidene-pentanoate Openeye Name: (2S)-5-amino-2-[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]-5-oxo-pentanoate CAS Name: (2S)-5-amino-2-[[2-(2-chloro-6-fluorophenyl)-1-oxoethyl]amino]-5-oxopentanoate IUPAC Name: (2S)-5-amino-2-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]-5-oxopentanoate Traditional Name: (2S)-5-amino-2-[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]-5-keto-valerate Formula: C13H13ClFN2O4- MolecularWeight: 315.704723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CC(=O)NC(CCC(=O)N)C(=O)[O-])F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CC(=O)N[C@@H](CCC(=O)N)C(=O)[O-])F

InChI

InChI=1S/C13H14ClFN2O4/c14-8-2-1-3-9(15)7(8)6-12(19)17-10(13(20)21)4-5-11(16)18/h1-3,10H,4-6H2,(H2,16,18)(H,17,19)(H,20,21)/p-1/t10-/m0/s1