(2S)-2-[(2-chloranyl-4-fluoranyl-phenyl)methylcarbamoylamino]pentanoate

Systemtic Name: (2S)-2-[(2-chloranyl-4-fluoranyl-phenyl)methylcarbamoylamino]pentanoate Openeye Name: (2S)-2-[(2-chloro-4-fluoro-phenyl)methylcarbamoylamino]pentanoate CAS Name: (2S)-2-[[[(2-chloro-4-fluorophenyl)methylamino]-oxomethyl]amino]pentanoate IUPAC Name: (2S)-2-[(2-chloro-4-fluorophenyl)methylcarbamoylamino]pentanoate Traditional Name: (2S)-2-[(2-chloro-4-fluoro-benzyl)carbamoylamino]valerate Formula: C13H15ClFN2O3- MolecularWeight: 301.721203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)[O-])NC(=O)NCC1=C(C=C(C=C1)F)Cl

Isomeric SMILES

CCC[C@@H](C(=O)[O-])NC(=O)NCC1=C(C=C(C=C1)F)Cl

InChI

InChI=1S/C13H16ClFN2O3/c1-2-3-11(12(18)19)17-13(20)16-7-8-4-5-9(15)6-10(8)14/h4-6,11H,2-3,7H2,1H3,(H,18,19)(H2,16,17,20)/p-1/t11-/m0/s1